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

Details

Stereochemistry ACHIRAL
Molecular Formula C42H38ClF3N2O6S2
Molecular Weight 823.339
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PF-5212372

SMILES

OC(=O)CCC1=CC=C(C=C1)S(=O)(=O)CCC2=C(CCNS(=O)(=O)CC3=C(C=CC=C3)C(F)(F)F)N(C(C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=C(Cl)C=C26

InChI

InChIKey=HWNIPKHEEVNHMN-UHFFFAOYSA-N
InChI=1S/C42H38ClF3N2O6S2/c43-33-18-21-38-36(27-33)35(24-26-55(51,52)34-19-15-29(16-20-34)17-22-40(49)50)39(48(38)41(30-9-3-1-4-10-30)31-11-5-2-6-12-31)23-25-47-56(53,54)28-32-13-7-8-14-37(32)42(44,45)46/h1-16,18-21,27,41,47H,17,22-26,28H2,(H,49,50)

HIDE SMILES / InChI

Approval Year

Name Type Language
PF-5212372
Code English
ZPL 5212372
Code English
4-((2-(5-CHLORO-1-(DIPHENYLMETHYL)-2-(2-((((2-(TRIFLUOROMETHYL)PHENYL)METHYL)SULFONYL)AMINO)ETHYL)-1H-INDOL-3-YL)ETHYL)SULFONYL)BENZENEPROPANOIC ACID
Systematic Name English
PLA-950
Code English
ZPL-521
Code English
PF-05212372
Code English
BENZENEPROPANOIC ACID, 4-((2-(5-CHLORO-1-(DIPHENYLMETHYL)-2-(2-((((2-(TRIFLUOROMETHYL)PHENYL)METHYL)SULFONYL)AMINO)ETHYL)-1H-INDOL-3-YL)ETHYL)SULFONYL)-
Systematic Name English
ZPL-5212372
Code English
Code System Code Type Description
FDA UNII
7LNI1E5EFA
Created by admin on Sat Dec 16 17:29:56 GMT 2023 , Edited by admin on Sat Dec 16 17:29:56 GMT 2023
PRIMARY
SMS_ID
300000041454
Created by admin on Sat Dec 16 17:29:56 GMT 2023 , Edited by admin on Sat Dec 16 17:29:56 GMT 2023
PRIMARY
PUBCHEM
15949539
Created by admin on Sat Dec 16 17:29:56 GMT 2023 , Edited by admin on Sat Dec 16 17:29:56 GMT 2023
PRIMARY
CAS
916136-25-9
Created by admin on Sat Dec 16 17:29:56 GMT 2023 , Edited by admin on Sat Dec 16 17:29:56 GMT 2023
PRIMARY