N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide

Systemtic Name: N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide Openeye Name: N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide CAS Name: N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]benzamide IUPAC Name: N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzamide Traditional Name: 2-[(2-keto-2-pyrrolidino-ethyl)thio]-N-(2-methyl-5-piperidinosulfonyl-phenyl)benzamide Formula: C25H31N3O4S2 MolecularWeight: 501.66134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=CC=C3SCC(=O)N4CCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=CC=C3SCC(=O)N4CCCC4

InChI

InChI=1S/C25H31N3O4S2/c1-19-11-12-20(34(31,32)28-15-5-2-6-16-28)17-22(19)26-25(30)21-9-3-4-10-23(21)33-18-24(29)27-13-7-8-14-27/h3-4,9-12,17H,2,5-8,13-16,18H2,1H3,(H,26,30)