2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)butanamide

Systemtic Name: 2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)butanamide Openeye Name: 4-methylsulfanyl-N-(2-oxo-2-pyrrolidin-1-yl-ethyl)-2-(p-tolylsulfonylamino)butanamide CAS Name: 2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)-N-[2-oxo-2-(1-pyrrolidinyl)ethyl]butanamide IUPAC Name: 2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)butanamide Traditional Name: N-(2-keto-2-pyrrolidino-ethyl)-4-(methylthio)-2-(tosylamino)butyramide Formula: C18H27N3O4S2 MolecularWeight: 413.55468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NCC(=O)N2CCCC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NCC(=O)N2CCCC2

InChI

InChI=1S/C18H27N3O4S2/c1-14-5-7-15(8-6-14)27(24,25)20-16(9-12-26-2)18(23)19-13-17(22)21-10-3-4-11-21/h5-8,16,20H,3-4,9-13H2,1-2H3,(H,19,23)