N-[1-[4-(4-ethanoylphenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide

Systemtic Name: N-[1-[4-(4-ethanoylphenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide Openeye Name: N-[1-[4-(4-acetylphenyl)piperazine-1-carbonyl]-3-methylsulfanyl-propyl]-3-methyl-benzamide CAS Name: N-[1-[4-(4-acetylphenyl)-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]-3-methylbenzamide IUPAC Name: N-[1-[4-(4-acetylphenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]-3-methylbenzamide Traditional Name: N-[1-[4-(4-acetylphenyl)piperazine-1-carbonyl]-3-(methylthio)propyl]-3-methyl-benzamide Formula: C25H31N3O3S MolecularWeight: 453.59694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31N3O3S/c1-18-5-4-6-21(17-18)24(30)26-23(11-16-32-3)25(31)28-14-12-27(13-15-28)22-9-7-20(8-10-22)19(2)29/h4-10,17,23H,11-16H2,1-3H3,(H,26,30)