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

Systemtic Name: 6-[[4-(3-methoxyphenyl)piperazin-1-yl]methyl]-2-methylsulfanyl-1H-pyrimidin-4-one Openeye Name: 6-[[4-(3-methoxyphenyl)piperazin-1-yl]methyl]-2-methylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-[[4-(3-methoxyphenyl)-1-piperazinyl]methyl]-2-(methylthio)-1H-pyrimidin-4-one IUPAC Name: 6-[[4-(3-methoxyphenyl)piperazin-1-yl]methyl]-2-methylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-[[4-(3-methoxyphenyl)piperazino]methyl]-2-(methylthio)-1H-pyrimidin-4-one Formula: C17H22N4O2S MolecularWeight: 346.44718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)CC3=CC(=O)N=C(N3)SC

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)CC3=CC(=O)N=C(N3)SC

InChI

InChI=1S/C17H22N4O2S/c1-23-15-5-3-4-14(11-15)21-8-6-20(7-9-21)12-13-10-16(22)19-17(18-13)24-2/h3-5,10-11H,6-9,12H2,1-2H3,(H,18,19,22)