N-[(2S)-1-oxidanylidene-3-(4-phenylmethoxyphenyl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-2-yl]ethanamide

Systemtic Name: N-[(2S)-1-oxidanylidene-3-(4-phenylmethoxyphenyl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-2-yl]ethanamide Openeye Name: N-[(1S)-1-[(4-benzyloxyphenyl)sulfanylmethyl]-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]acetamide CAS Name: N-[(2S)-1-oxo-3-[(4-phenylmethoxyphenyl)thio]-1-(4-phenyl-1-piperazinyl)propan-2-yl]acetamide IUPAC Name: N-[(2S)-1-oxo-3-(4-phenylmethoxyphenyl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-2-yl]acetamide Traditional Name: N-[(1S)-1-[[(4-benzoxyphenyl)thio]methyl]-2-keto-2-(4-phenylpiperazino)ethyl]acetamide Formula: C28H31N3O3S MolecularWeight: 489.62904

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N[C@H](CSC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C28H31N3O3S/c1-22(32)29-27(28(33)31-18-16-30(17-19-31)24-10-6-3-7-11-24)21-35-26-14-12-25(13-15-26)34-20-23-8-4-2-5-9-23/h2-15,27H,16-21H2,1H3,(H,29,32)/t27-/m1/s1