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

Systemtic Name: N-[(2S)-1-oxidanylidene-3-(4-phenoxyphenyl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-2-yl]ethanamide Openeye Name: N-[(1S)-2-oxo-1-[(4-phenoxyphenyl)sulfanylmethyl]-2-(4-phenylpiperazin-1-yl)ethyl]acetamide CAS Name: N-[(2S)-1-oxo-3-[(4-phenoxyphenyl)thio]-1-(4-phenyl-1-piperazinyl)propan-2-yl]acetamide IUPAC Name: N-[(2S)-1-oxo-3-(4-phenoxyphenyl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-2-yl]acetamide Traditional Name: N-[(1S)-2-keto-1-[[(4-phenoxyphenyl)thio]methyl]-2-(4-phenylpiperazino)ethyl]acetamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N[C@H](CSC1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C27H29N3O3S/c1-21(31)28-26(27(32)30-18-16-29(17-19-30)22-8-4-2-5-9-22)20-34-25-14-12-24(13-15-25)33-23-10-6-3-7-11-23/h2-15,26H,16-20H2,1H3,(H,28,31)/t26-/m1/s1