6-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-2-methylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-2-methylsulfanyl-1H-pyrimidin-4-one Openeye Name: 6-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-2-methylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-[[4-(2,3-dimethylphenyl)-1-piperazinyl]methyl]-2-(methylthio)-1H-pyrimidin-4-one IUPAC Name: 6-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-2-methylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-[[4-(2,3-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=C(C(=CC=C1)N2CCN(CC2)CC3=CC(=O)N=C(N3)SC)C

Isomeric SMILES

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

InChI

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