(3S)-N-methyl-1-(4-methylphenyl)-N-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-methyl-1-(4-methylphenyl)-N-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-methyl-N-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]-5-oxo-1-(p-tolyl)pyrrolidine-3-carboxamide CAS Name: (3S)-N-methyl-1-(4-methylphenyl)-N-[2-[2-(methylthio)anilino]-2-oxoethyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-methyl-1-(4-methylphenyl)-N-[2-(2-methylsulfanylanilino)-2-oxoethyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-5-keto-N-[2-keto-2-[2-(methylthio)anilino]ethyl]-N-methyl-1-(p-tolyl)pyrrolidine-3-carboxamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)N(C)CC(=O)NC3=CC=CC=C3SC

Isomeric SMILES

CC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)N(C)CC(=O)NC3=CC=CC=C3SC

InChI

InChI=1S/C22H25N3O3S/c1-15-8-10-17(11-9-15)25-13-16(12-21(25)27)22(28)24(2)14-20(26)23-18-6-4-5-7-19(18)29-3/h4-11,16H,12-14H2,1-3H3,(H,23,26)/t16-/m0/s1