N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]acetamide CAS Name: N-[5-(diethylsulfamoyl)-2-(1-pyrrolidinyl)phenyl]-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-ylphenyl]acetamide Traditional Name: 2-(benzylthio)-N-[5-(diethylsulfamoyl)-2-pyrrolidino-phenyl]acetamide Formula: C23H31N3O3S2 MolecularWeight: 461.64054

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=O)CSCC3=CC=CC=C3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=O)CSCC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O3S2/c1-3-26(4-2)31(28,29)20-12-13-22(25-14-8-9-15-25)21(16-20)24-23(27)18-30-17-19-10-6-5-7-11-19/h5-7,10-13,16H,3-4,8-9,14-15,17-18H2,1-2H3,(H,24,27)