U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C40H50N8O6.2ClH
Molecular Weight 811.797
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DACLATASVIR DIHYDROCHLORIDE

SMILES

Cl.Cl.COC(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C2=NC=C(N2)C3=CC=C(C=C3)C4=CC=C(C=C4)C5=CN=C(N5)[C@@H]6CCCN6C(=O)[C@@H](NC(=O)OC)C(C)C

InChI

InChIKey=BVZLLUDATICXCI-JMSCDMLISA-N
InChI=1S/C40H50N8O6.2ClH/c1-23(2)33(45-39(51)53-5)37(49)47-19-7-9-31(47)35-41-21-29(43-35)27-15-11-25(12-16-27)26-13-17-28(18-14-26)30-22-42-36(44-30)32-10-8-20-48(32)38(50)34(24(3)4)46-40(52)54-6;;/h11-18,21-24,31-34H,7-10,19-20H2,1-6H3,(H,41,43)(H,42,44)(H,45,51)(H,46,52);2*1H/t31-,32-,33-,34-;;/m0../s1

HIDE SMILES / InChI

Approval Year

Name Type Language
DACLATASVIR DIHYDROCHLORIDE
USAN   WHO-DD  
USAN  
Official Name English
CARBAMIC ACID, N,N'-((1,1'-BIPHENYL)-4,4'-DIYLBIS(1H-IMIDAZOLE-5,2-DIYL-(2S)-2,1-PYRROLIDINEDIYL((1S)-1-(1-METHYLETHYL)-2-OXO-2,1-ETHANEDIYL)))BIS-, C,C'-DIMETHYL ESTER, HYDROCHLORIDE (1:2)
Common Name English
METHYL N-((2S)-1-((2S)-2-(5-(4-(4'-(2-((2S)-1-((2S)-2-(METHOXYCARBONYLAMINO)-3-METHYLBUTANOYL)PYRROLIDIN-2-YL)-1H-IMIDAZOL-5-YL)PHENYL)PHENYL)-1H-IMIDAZOL-2-YL)PYRROLIDIN-1-YL)-3-METHYL-1-OXOBUTAN-2-YL)CARBAMATE DIHYDROCHLORIDE
Common Name English
DACLATASVIR DIHYDROCHLORIDE [ORANGE BOOK]
Common Name English
DAKLINZA
Brand Name English
Daclatasvir dihydrochloride [WHO-DD]
Common Name English
DIMETHYL N,N'-(BIPHENYL-4,4'-DIYLBIS(1H-IMIDAZOLE-5,2-DIYL-((2S)-PYRROLIDINE-2,1- DIYL)((1S)-1-(1-METHYLETHYL)-2-OXOETHANE-2,1-DIYL)))DICARBAMATE DIHYDROCHLORIDE
Common Name English
BMS-790052-05
Code English
DACLATASVIR HYDROCHLORIDE
JAN  
Official Name English
DACLATASVIR DIHYDROCHLORIDE [USAN]
Common Name English
DACLATASVIR DIHYDROCHLORIDE [MI]
Common Name English
DACLATASVIR HYDROCHLORIDE [JAN]
Common Name English
BMS 790052-05
Code English
Classification Tree Code System Code
EMA ASSESSMENT REPORTS DAKLINZA (AUTHORIZED: HEPATITIS C, CHRONIC)
Created by admin on Fri Dec 15 20:15:01 UTC 2023 , Edited by admin on Fri Dec 15 20:15:01 UTC 2023
Code System Code Type Description
USAN
XX-59
Created by admin on Fri Dec 15 20:15:01 UTC 2023 , Edited by admin on Fri Dec 15 20:15:01 UTC 2023
PRIMARY
CHEBI
83800
Created by admin on Fri Dec 15 20:15:01 UTC 2023 , Edited by admin on Fri Dec 15 20:15:01 UTC 2023
PRIMARY
JAPANESE REVIEW
DAKLINZA
Created by admin on Fri Dec 15 20:15:01 UTC 2023 , Edited by admin on Fri Dec 15 20:15:01 UTC 2023
PRIMARY APPROVED JULY 2014
FDA UNII
50ZO25C11D
Created by admin on Fri Dec 15 20:15:01 UTC 2023 , Edited by admin on Fri Dec 15 20:15:01 UTC 2023
PRIMARY
SMS_ID
100000156586
Created by admin on Fri Dec 15 20:15:01 UTC 2023 , Edited by admin on Fri Dec 15 20:15:01 UTC 2023
PRIMARY
CAS
1009119-65-6
Created by admin on Fri Dec 15 20:15:01 UTC 2023 , Edited by admin on Fri Dec 15 20:15:01 UTC 2023
PRIMARY
DRUG BANK
DBSALT001166
Created by admin on Fri Dec 15 20:15:01 UTC 2023 , Edited by admin on Fri Dec 15 20:15:01 UTC 2023
PRIMARY
EPA CompTox
DTXSID201027744
Created by admin on Fri Dec 15 20:15:01 UTC 2023 , Edited by admin on Fri Dec 15 20:15:01 UTC 2023
PRIMARY
ChEMBL
CHEMBL2023898
Created by admin on Fri Dec 15 20:15:01 UTC 2023 , Edited by admin on Fri Dec 15 20:15:01 UTC 2023
PRIMARY
NCI_THESAURUS
C166798
Created by admin on Fri Dec 15 20:15:01 UTC 2023 , Edited by admin on Fri Dec 15 20:15:01 UTC 2023
PRIMARY
PUBCHEM
25154713
Created by admin on Fri Dec 15 20:15:01 UTC 2023 , Edited by admin on Fri Dec 15 20:15:01 UTC 2023
PRIMARY
MERCK INDEX
m11764
Created by admin on Fri Dec 15 20:15:01 UTC 2023 , Edited by admin on Fri Dec 15 20:15:01 UTC 2023
PRIMARY
RXCUI
1606217
Created by admin on Fri Dec 15 20:15:01 UTC 2023 , Edited by admin on Fri Dec 15 20:15:01 UTC 2023
PRIMARY RxNorm
EVMPD
SUB130532
Created by admin on Fri Dec 15 20:15:01 UTC 2023 , Edited by admin on Fri Dec 15 20:15:01 UTC 2023
PRIMARY