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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H36N4O2S.ClH
Molecular Weight 529.137
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LURASIDONE HYDROCHLORIDE

SMILES

Cl.[H][C@@]12[C@H]3CC[C@H](C3)[C@]1([H])C(=O)N(C[C@@H]4CCCC[C@H]4CN5CCN(CC5)C6=NSC7=C6C=CC=C7)C2=O

InChI

InChIKey=NEKCRUIRPWNMLK-SCIYSFAVSA-N
InChI=1S/C28H36N4O2S.ClH/c33-27-24-18-9-10-19(15-18)25(24)28(34)32(27)17-21-6-2-1-5-20(21)16-30-11-13-31(14-12-30)26-22-7-3-4-8-23(22)35-29-26;/h3-4,7-8,18-21,24-25H,1-2,5-6,9-17H2;1H/t18-,19+,20-,21-,24+,25-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C28H36N4O2S
Molecular Weight 492.676
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:52:33 UTC 2023
Edited
by admin
on Fri Dec 15 15:52:33 UTC 2023
Record UNII
O0P4I5851I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LURASIDONE HYDROCHLORIDE
DASH   MART.   MI   ORANGE BOOK   USAN   VANDF   WHO-DD  
USAN  
Official Name English
LURASIDONE HYDROCHLORIDE [USAN]
Common Name English
Lurasidone hydrochloride [WHO-DD]
Common Name English
LURASIDONE HYDROCHLORIDE [MART.]
Common Name English
SM-13496
Code English
LURASIDONE HYDROCHLORIDE [MI]
Common Name English
(3AR,4S,7R,7AS)-2-((1R,2R)-2-(1,2-BENZISOTHIAZOL-3-YL)PIPERAZIN-1-YLMETHYL)CYCLOHEXYLMETHYL)HEXAHYDRO-4,7-METHANO-2H-ISOINDOLE-1,3-DIONE, HYDROCHLORIDE
Common Name English
LURASIDONE HYDROCHLORIDE [VANDF]
Common Name English
LURASIDONE HYDROCHLORIDE [JAN]
Common Name English
LURASIDONE HYDROCHLORIDE [ORANGE BOOK]
Common Name English
LURASIDONE HCL
Common Name English
4,7-METHANO-1H-ISOINDOLE-1,3(2H)-DIONE, 2-(((1R,2R)-2-((4-(1,2-BENZISOTHIAZOL-3-YL)-1-PIPERAZINYL)METHYL)CYCLOHEXYL)METHYL)HEXAHYDRO-, MONOHYDROCHLORIDE, (3AR,4S,7R,7AS)-
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C66883
Created by admin on Fri Dec 15 15:52:34 UTC 2023 , Edited by admin on Fri Dec 15 15:52:34 UTC 2023
NCI_THESAURUS C66885
Created by admin on Fri Dec 15 15:52:34 UTC 2023 , Edited by admin on Fri Dec 15 15:52:34 UTC 2023
Code System Code Type Description
USAN
RR-74
Created by admin on Fri Dec 15 15:52:34 UTC 2023 , Edited by admin on Fri Dec 15 15:52:34 UTC 2023
PRIMARY
DRUG BANK
DBSALT000113
Created by admin on Fri Dec 15 15:52:34 UTC 2023 , Edited by admin on Fri Dec 15 15:52:34 UTC 2023
PRIMARY
EPA CompTox
DTXSID401027714
Created by admin on Fri Dec 15 15:52:34 UTC 2023 , Edited by admin on Fri Dec 15 15:52:34 UTC 2023
PRIMARY
ChEMBL
CHEMBL1237021
Created by admin on Fri Dec 15 15:52:34 UTC 2023 , Edited by admin on Fri Dec 15 15:52:34 UTC 2023
PRIMARY
SMS_ID
100000127954
Created by admin on Fri Dec 15 15:52:34 UTC 2023 , Edited by admin on Fri Dec 15 15:52:34 UTC 2023
PRIMARY
RXCUI
1040027
Created by admin on Fri Dec 15 15:52:34 UTC 2023 , Edited by admin on Fri Dec 15 15:52:34 UTC 2023
PRIMARY RxNorm
DAILYMED
O0P4I5851I
Created by admin on Fri Dec 15 15:52:34 UTC 2023 , Edited by admin on Fri Dec 15 15:52:34 UTC 2023
PRIMARY
CHEBI
70732
Created by admin on Fri Dec 15 15:52:34 UTC 2023 , Edited by admin on Fri Dec 15 15:52:34 UTC 2023
PRIMARY
NCI_THESAURUS
C77576
Created by admin on Fri Dec 15 15:52:34 UTC 2023 , Edited by admin on Fri Dec 15 15:52:34 UTC 2023
PRIMARY
MERCK INDEX
m6943
Created by admin on Fri Dec 15 15:52:34 UTC 2023 , Edited by admin on Fri Dec 15 15:52:34 UTC 2023
PRIMARY Merck Index
CAS
367514-88-3
Created by admin on Fri Dec 15 15:52:34 UTC 2023 , Edited by admin on Fri Dec 15 15:52:34 UTC 2023
PRIMARY
FDA UNII
O0P4I5851I
Created by admin on Fri Dec 15 15:52:34 UTC 2023 , Edited by admin on Fri Dec 15 15:52:34 UTC 2023
PRIMARY
EVMPD
SUB34204
Created by admin on Fri Dec 15 15:52:34 UTC 2023 , Edited by admin on Fri Dec 15 15:52:34 UTC 2023
PRIMARY
PUBCHEM
11237860
Created by admin on Fri Dec 15 15:52:34 UTC 2023 , Edited by admin on Fri Dec 15 15:52:34 UTC 2023
PRIMARY
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