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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H28ClFN2OS
Molecular Weight 483.04
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CRINECERFONT

SMILES

COC1=CC(Cl)=C(C=C1C)C2=C(C)SC(=N2)N(CC#C)[C@@H](CC3CC3)C4=CC(F)=C(C)C=C4

InChI

InChIKey=IEAKXXNRGSLYTQ-DEOSSOPVSA-N
InChI=1S/C27H28ClFN2OS/c1-6-11-31(24(13-19-8-9-19)20-10-7-16(2)23(29)14-20)27-30-26(18(4)33-27)21-12-17(3)25(32-5)15-22(21)28/h1,7,10,12,14-15,19,24H,8-9,11,13H2,2-5H3/t24-/m0/s1

HIDE SMILES / InChI

Molecular Formula C27H28ClFN2OS
Molecular Weight 483.04
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:35:08 UTC 2023
Edited
by admin
on Sat Dec 16 10:35:08 UTC 2023
Record UNII
MFT24BX55I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CRINECERFONT
USAN   INN  
Official Name English
NBI-74788
Code English
06-RORI
Code English
2-Thiazolamine, 4-(2-chloro-4-methoxy-5-methylphenyl)-N-[(1S)-2-cyclopropyl-1-(3-fluoro-4-methylphenyl)ethyl]-5-methyl-N-2-propyn-1-yl
Systematic Name English
SSR-125543
Code English
4-(2-chloro-4-methoxy-5-methylphenyl)-N-[(1S)-2-cyclopropyl-1-(3-fluoro-4-methylphenyl)ethyl]-5-methyl-N-prop-2-ynyl-1,3-thiazol-2-amine
Systematic Name English
CRINECERFONT [USAN]
Common Name English
crinecerfont [INN]
Common Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 639018
Created by admin on Sat Dec 16 10:35:08 UTC 2023 , Edited by admin on Sat Dec 16 10:35:08 UTC 2023
Code System Code Type Description
CAS
752253-39-7
Created by admin on Sat Dec 16 10:35:08 UTC 2023 , Edited by admin on Sat Dec 16 10:35:08 UTC 2023
PRIMARY
EPA CompTox
DTXSID10996687
Created by admin on Sat Dec 16 10:35:08 UTC 2023 , Edited by admin on Sat Dec 16 10:35:08 UTC 2023
PRIMARY
NCI_THESAURUS
C174708
Created by admin on Sat Dec 16 10:35:08 UTC 2023 , Edited by admin on Sat Dec 16 10:35:08 UTC 2023
PRIMARY
EVMPD
SUB197132
Created by admin on Sat Dec 16 10:35:08 UTC 2023 , Edited by admin on Sat Dec 16 10:35:08 UTC 2023
PRIMARY
SMS_ID
100000182802
Created by admin on Sat Dec 16 10:35:08 UTC 2023 , Edited by admin on Sat Dec 16 10:35:08 UTC 2023
PRIMARY
INN
10958
Created by admin on Sat Dec 16 10:35:08 UTC 2023 , Edited by admin on Sat Dec 16 10:35:08 UTC 2023
PRIMARY
FDA UNII
MFT24BX55I
Created by admin on Sat Dec 16 10:35:08 UTC 2023 , Edited by admin on Sat Dec 16 10:35:08 UTC 2023
PRIMARY
USAN
KL-46
Created by admin on Sat Dec 16 10:35:08 UTC 2023 , Edited by admin on Sat Dec 16 10:35:08 UTC 2023
PRIMARY
ChEMBL
CHEMBL291657
Created by admin on Sat Dec 16 10:35:08 UTC 2023 , Edited by admin on Sat Dec 16 10:35:08 UTC 2023
PRIMARY
PUBCHEM
5282340
Created by admin on Sat Dec 16 10:35:08 UTC 2023 , Edited by admin on Sat Dec 16 10:35:08 UTC 2023
PRIMARY
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TARGET -> INHIBITOR
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