N-[(2S)-1-[(4-dimethylaminophenyl)methylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[(2S)-1-[(4-dimethylaminophenyl)methylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[(1S)-1-[(4-dimethylaminophenyl)methylcarbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: N-[(2S)-1-[(4-dimethylaminophenyl)methylamino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: N-[(2S)-1-[(4-dimethylaminophenyl)methylamino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: N-[(1S)-1-[[4-(dimethylamino)benzyl]carbamoyl]-3-(methylthio)propyl]benzamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC(=O)C(CCSC)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=O)[C@H](CCSC)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H27N3O2S/c1-24(2)18-11-9-16(10-12-18)15-22-21(26)19(13-14-27-3)23-20(25)17-7-5-4-6-8-17/h4-12,19H,13-15H2,1-3H3,(H,22,26)(H,23,25)/t19-/m0/s1