6-[[4-(2,5-dimethylphenyl)piperazin-1-yl]methyl]-2-methylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-[[4-(2,5-dimethylphenyl)piperazin-1-yl]methyl]-2-methylsulfanyl-1H-pyrimidin-4-one Openeye Name: 6-[[4-(2,5-dimethylphenyl)piperazin-1-yl]methyl]-2-methylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-[[4-(2,5-dimethylphenyl)-1-piperazinyl]methyl]-2-(methylthio)-1H-pyrimidin-4-one IUPAC Name: 6-[[4-(2,5-dimethylphenyl)piperazin-1-yl]methyl]-2-methylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-[[4-(2,5-dimethylphenyl)piperazino]methyl]-2-(methylthio)-1H-pyrimidin-4-one Formula: C18H24N4OS MolecularWeight: 344.47436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)CC3=CC(=O)N=C(N3)SC

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)CC3=CC(=O)N=C(N3)SC

InChI

InChI=1S/C18H24N4OS/c1-13-4-5-14(2)16(10-13)22-8-6-21(7-9-22)12-15-11-17(23)20-18(19-15)24-3/h4-5,10-11H,6-9,12H2,1-3H3,(H,19,20,23)