N-[(2S)-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[(2S)-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[(1S)-1-[4-[(4-chlorophenyl)methyl]piperazine-1-carbonyl]-3-methylsulfanyl-propyl]benzamide CAS Name: N-[(2S)-1-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: N-[(2S)-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: N-[(1S)-1-[4-(4-chlorobenzyl)piperazine-1-carbonyl]-3-(methylthio)propyl]benzamide Formula: C23H28ClN3O2S MolecularWeight: 446.00532

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCN(CC1)CC2=CC=C(C=C2)Cl)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CSCC[C@@H](C(=O)N1CCN(CC1)CC2=CC=C(C=C2)Cl)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H28ClN3O2S/c1-30-16-11-21(25-22(28)19-5-3-2-4-6-19)23(29)27-14-12-26(13-15-27)17-18-7-9-20(24)10-8-18/h2-10,21H,11-17H2,1H3,(H,25,28)/t21-/m0/s1