5-[2-[4-(4-ethanoylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-6-methyl-2-(phenylmethylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 5-[2-[4-(4-ethanoylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-6-methyl-2-(phenylmethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 5-[2-[4-(4-acetylphenyl)piperazin-1-yl]-2-oxo-ethyl]-2-benzylsulfanyl-6-methyl-1H-pyrimidin-4-one CAS Name: 5-[2-[4-(4-acetylphenyl)-1-piperazinyl]-2-oxoethyl]-6-methyl-2-(phenylmethylthio)-1H-pyrimidin-4-one IUPAC Name: 5-[2-[4-(4-acetylphenyl)piperazin-1-yl]-2-oxoethyl]-2-benzylsulfanyl-6-methyl-1H-pyrimidin-4-one Traditional Name: 5-[2-[4-(4-acetylphenyl)piperazino]-2-keto-ethyl]-2-(benzylthio)-6-methyl-1H-pyrimidin-4-one Formula: C26H28N4O3S MolecularWeight: 476.59052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CC(=O)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CC(=O)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C

InChI

InChI=1S/C26H28N4O3S/c1-18-23(25(33)28-26(27-18)34-17-20-6-4-3-5-7-20)16-24(32)30-14-12-29(13-15-30)22-10-8-21(9-11-22)19(2)31/h3-11H,12-17H2,1-2H3,(H,27,28,33)