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

Systemtic Name: N-[(2S)-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)-3-phenylsulfanyl-propan-2-yl]ethanamide Openeye Name: N-[(1S)-2-oxo-2-(4-phenylpiperazin-1-yl)-1-(phenylsulfanylmethyl)ethyl]acetamide CAS Name: N-[(2S)-1-oxo-1-(4-phenyl-1-piperazinyl)-3-(phenylthio)propan-2-yl]acetamide IUPAC Name: N-[(2S)-1-oxo-1-(4-phenylpiperazin-1-yl)-3-phenylsulfanylpropan-2-yl]acetamide Traditional Name: N-[(1S)-2-keto-2-(4-phenylpiperazino)-1-[(phenylthio)methyl]ethyl]acetamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC1=CC=CC=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)N[C@H](CSC1=CC=CC=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H25N3O2S/c1-17(25)22-20(16-27-19-10-6-3-7-11-19)21(26)24-14-12-23(13-15-24)18-8-4-2-5-9-18/h2-11,20H,12-16H2,1H3,(H,22,25)/t20-/m1/s1