N-[(2S)-1-(4-ethanoylpiperazin-1-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[(2S)-1-(4-ethanoylpiperazin-1-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide Openeye Name: N-[(1S)-1-(4-acetylpiperazine-1-carbonyl)-3-methylsulfanyl-propyl]-2-phenoxy-acetamide CAS Name: N-[(2S)-1-(4-acetyl-1-piperazinyl)-4-(methylthio)-1-oxobutan-2-yl]-2-phenoxyacetamide IUPAC Name: N-[(2S)-1-(4-acetylpiperazin-1-yl)-4-methylsulfanyl-1-oxobutan-2-yl]-2-phenoxyacetamide Traditional Name: N-[(1S)-1-(4-acetylpiperazine-1-carbonyl)-3-(methylthio)propyl]-2-phenoxy-acetamide Formula: C19H27N3O4S MolecularWeight: 393.50038

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C(CCSC)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)[C@H](CCSC)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C19H27N3O4S/c1-15(23)21-9-11-22(12-10-21)19(25)17(8-13-27-2)20-18(24)14-26-16-6-4-3-5-7-16/h3-7,17H,8-14H2,1-2H3,(H,20,24)/t17-/m0/s1