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

Systemtic Name: N-[1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide Openeye Name: N-[1-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-3-methylsulfanyl-propyl]-2-phenoxy-acetamide CAS Name: N-[1-[4-(2,3-dimethylphenyl)-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]-2-phenoxyacetamide IUPAC Name: N-[1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]-2-phenoxyacetamide Traditional Name: N-[1-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-3-(methylthio)propyl]-2-phenoxy-acetamide Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33N3O3S/c1-19-8-7-11-23(20(19)2)27-13-15-28(16-14-27)25(30)22(12-17-32-3)26-24(29)18-31-21-9-5-4-6-10-21/h4-11,22H,12-18H2,1-3H3,(H,26,29)