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

Systemtic Name: N-[(2S)-1-[4-(2-chlorophenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide Openeye Name: N-[(1S)-1-[4-(2-chlorophenyl)piperazine-1-carbonyl]-3-methylsulfanyl-propyl]-2-phenoxy-acetamide CAS Name: N-[(2S)-1-[4-(2-chlorophenyl)-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]-2-phenoxyacetamide IUPAC Name: N-[(2S)-1-[4-(2-chlorophenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]-2-phenoxyacetamide Traditional Name: N-[(1S)-1-[4-(2-chlorophenyl)piperazine-1-carbonyl]-3-(methylthio)propyl]-2-phenoxy-acetamide Formula: C23H28ClN3O3S MolecularWeight: 462.00472

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCN(CC1)C2=CC=CC=C2Cl)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CSCC[C@@H](C(=O)N1CCN(CC1)C2=CC=CC=C2Cl)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C23H28ClN3O3S/c1-31-16-11-20(25-22(28)17-30-18-7-3-2-4-8-18)23(29)27-14-12-26(13-15-27)21-10-6-5-9-19(21)24/h2-10,20H,11-17H2,1H3,(H,25,28)/t20-/m0/s1