(3S)-N-[(4-dimethylaminophenyl)methyl]-N-methyl-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-[(4-dimethylaminophenyl)methyl]-N-methyl-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-[(4-dimethylaminophenyl)methyl]-N-methyl-1-(3-methylsulfanylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-N-[(4-dimethylaminophenyl)methyl]-N-methyl-1-[3-(methylthio)phenyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-[(4-dimethylaminophenyl)methyl]-N-methyl-1-(3-methylsulfanylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-N-[4-(dimethylamino)benzyl]-5-keto-N-methyl-1-[3-(methylthio)phenyl]pyrrolidine-3-carboxamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CN(C)C(=O)C2CC(=O)N(C2)C3=CC(=CC=C3)SC

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CN(C)C(=O)[C@H]2CC(=O)N(C2)C3=CC(=CC=C3)SC

InChI

InChI=1S/C22H27N3O2S/c1-23(2)18-10-8-16(9-11-18)14-24(3)22(27)17-12-21(26)25(15-17)19-6-5-7-20(13-19)28-4/h5-11,13,17H,12,14-15H2,1-4H3/t17-/m0/s1