N-[1-[4-(3-methylphenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[1-[4-(3-methylphenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide Openeye Name: N-[3-methylsulfanyl-1-[4-(m-tolyl)piperazine-1-carbonyl]propyl]-2-phenoxy-acetamide CAS Name: N-[1-[4-(3-methylphenyl)-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]-2-phenoxyacetamide IUPAC Name: N-[1-[4-(3-methylphenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]-2-phenoxyacetamide Traditional Name: N-[3-(methylthio)-1-[4-(m-tolyl)piperazine-1-carbonyl]propyl]-2-phenoxy-acetamide Formula: C24H31N3O3S MolecularWeight: 441.58624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C(CCSC)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C(CCSC)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C24H31N3O3S/c1-19-7-6-8-20(17-19)26-12-14-27(15-13-26)24(29)22(11-16-31-2)25-23(28)18-30-21-9-4-3-5-10-21/h3-10,17,22H,11-16,18H2,1-2H3,(H,25,28)