(4-methyl-2-methylsulfanyl-pyrimidin-5-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (4-methyl-2-methylsulfanyl-pyrimidin-5-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (4-methyl-2-methylsulfanyl-pyrimidin-5-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [4-methyl-2-(methylthio)-5-pyrimidinyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (4-methyl-2-methylsulfanylpyrimidin-5-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [4-methyl-2-(methylthio)pyrimidin-5-yl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C15H18N6OS MolecularWeight: 330.40802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)N2CCN(CC2)C3=NC=CC=N3)SC

Isomeric SMILES

CC1=NC(=NC=C1C(=O)N2CCN(CC2)C3=NC=CC=N3)SC

InChI

InChI=1S/C15H18N6OS/c1-11-12(10-18-15(19-11)23-2)13(22)20-6-8-21(9-7-20)14-16-4-3-5-17-14/h3-5,10H,6-9H2,1-2H3