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Details

Stereochemistry RACEMIC
Molecular Formula C29H33Cl2N3O4S
Molecular Weight 590.561
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 3
E/Z Centers 0
Charge 0
Stereo Comments UNKNOWN STEREO ON PIPERIDINE RING

SHOW SMILES / InChI
Structure of A-324920

SMILES

OC(=O)C1CCCN(C1)C2=CC=CC=C2SC3=CC=C([C@@H]4C[C@H]4C(=O)NCCCN5CCCC5=O)C(Cl)=C3Cl

InChI

InChIKey=CYHYOQQJILLXPV-QYAPWVIVSA-N
InChI=1S/C29H33Cl2N3O4S/c30-26-19(20-16-21(20)28(36)32-12-5-15-33-13-4-9-25(33)35)10-11-24(27(26)31)39-23-8-2-1-7-22(23)34-14-3-6-18(17-34)29(37)38/h1-2,7-8,10-11,18,20-21H,3-6,9,12-17H2,(H,32,36)(H,37,38)/t18?,20-,21+/m0/s1

HIDE SMILES / InChI

Molecular Formula C29H33Cl2N3O4S
Molecular Weight 590.561
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 2 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:34:42 GMT 2023
Edited
by admin
on Sat Dec 16 08:34:42 GMT 2023
Record UNII
D7D824204H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
A-324920
Common Name English
3-PIPERIDINECARBOXYLIC ACID, 1-(2-((2,3-DICHLORO-4-((1R,2R)-2-(((3-(2-OXO-1-PYRROLIDINYL)PROPYL)AMINO)CARBONYL)CYCLOPROPYL)PHENYL)THIO)PHENYL)-, REL-
Systematic Name English
Code System Code Type Description
FDA UNII
D7D824204H
Created by admin on Sat Dec 16 08:34:42 GMT 2023 , Edited by admin on Sat Dec 16 08:34:42 GMT 2023
PRIMARY
PUBCHEM
69781440
Created by admin on Sat Dec 16 08:34:42 GMT 2023 , Edited by admin on Sat Dec 16 08:34:42 GMT 2023
PRIMARY
CAS
350592-74-4
Created by admin on Sat Dec 16 08:34:42 GMT 2023 , Edited by admin on Sat Dec 16 08:34:42 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY