1-(4-chlorophenyl)sulfonyl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-1-(4-chlorophenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: 1-(4-chlorophenyl)sulfonyl-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-1-(4-chlorophenyl)sulfonyl-pyrrolidine-2-carboxamide Formula: C20H19ClN4O3S3 MolecularWeight: 495.03786

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)NC3=NN=C(S3)SCC4=CC=CC=C4

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)NC3=NN=C(S3)SCC4=CC=CC=C4

InChI

InChI=1S/C20H19ClN4O3S3/c21-15-8-10-16(11-9-15)31(27,28)25-12-4-7-17(25)18(26)22-19-23-24-20(30-19)29-13-14-5-2-1-3-6-14/h1-3,5-6,8-11,17H,4,7,12-13H2,(H,22,23,26)