4-chloranyl-3-pyrrolidin-1-ylsulfonyl-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]benzamide

Systemtic Name: 4-chloranyl-3-pyrrolidin-1-ylsulfonyl-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]benzamide Openeye Name: 4-chloro-3-pyrrolidin-1-ylsulfonyl-N-[2-(3-thienylmethylsulfanyl)phenyl]benzamide CAS Name: 4-chloro-3-(1-pyrrolidinylsulfonyl)-N-[2-(3-thiophenylmethylthio)phenyl]benzamide IUPAC Name: 4-chloro-3-pyrrolidin-1-ylsulfonyl-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]benzamide Traditional Name: 4-chloro-3-pyrrolidinosulfonyl-N-[2-(3-thenylthio)phenyl]benzamide Formula: C22H21ClN2O3S3 MolecularWeight: 493.06174

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=CC=C3SCC4=CSC=C4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=CC=C3SCC4=CSC=C4)Cl

InChI

InChI=1S/C22H21ClN2O3S3/c23-18-8-7-17(13-21(18)31(27,28)25-10-3-4-11-25)22(26)24-19-5-1-2-6-20(19)30-15-16-9-12-29-14-16/h1-2,5-9,12-14H,3-4,10-11,15H2,(H,24,26)