N-[(2S)-1-[4-(diphenylmethyl)piperazin-1-yl]-3-(4-methylphenyl)sulfanyl-1-oxidanylidene-propan-2-yl]ethanamide

Systemtic Name: N-[(2S)-1-[4-(diphenylmethyl)piperazin-1-yl]-3-(4-methylphenyl)sulfanyl-1-oxidanylidene-propan-2-yl]ethanamide Openeye Name: N-[(1S)-2-(4-benzhydrylpiperazin-1-yl)-2-oxo-1-(p-tolylsulfanylmethyl)ethyl]acetamide CAS Name: N-[(2S)-1-[4-(diphenylmethyl)-1-piperazinyl]-3-[(4-methylphenyl)thio]-1-oxopropan-2-yl]acetamide IUPAC Name: N-[(2S)-1-(4-benzhydrylpiperazin-1-yl)-3-(4-methylphenyl)sulfanyl-1-oxopropan-2-yl]acetamide Traditional Name: N-[(1S)-2-(4-benzhydrylpiperazino)-2-keto-1-[(p-tolylthio)methyl]ethyl]acetamide Formula: C29H33N3O2S MolecularWeight: 487.65622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)SC[C@H](C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)C

InChI

InChI=1S/C29H33N3O2S/c1-22-13-15-26(16-14-22)35-21-27(30-23(2)33)29(34)32-19-17-31(18-20-32)28(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-16,27-28H,17-21H2,1-2H3,(H,30,33)/t27-/m1/s1