2-(4,6-dimethylpyrimidin-2-yl)-5-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-4H-pyrazol-3-one

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-4H-pyrazol-3-one Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-4H-pyrazol-3-one CAS Name: 2-(4,6-dimethyl-2-pyrimidinyl)-5-[[(4-methyl-2-pyrimidinyl)thio]methyl]-4H-pyrazol-3-one IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-4H-pyrazol-3-one Traditional Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-[[(4-methylpyrimidin-2-yl)thio]methyl]-2-pyrazolin-3-one Formula: C15H16N6OS MolecularWeight: 328.39214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCC2=NN(C(=O)C2)C3=NC(=CC(=N3)C)C

Isomeric SMILES

CC1=NC(=NC=C1)SCC2=NN(C(=O)C2)C3=NC(=CC(=N3)C)C

InChI

InChI=1S/C15H16N6OS/c1-9-4-5-16-15(19-9)23-8-12-7-13(22)21(20-12)14-17-10(2)6-11(3)18-14/h4-6H,7-8H2,1-3H3