3-methyl-5-(3-methylphenyl)-2-methylsulfanyl-6-pyridin-4-yl-pyrimidin-4-one

Systemtic Name: 3-methyl-5-(3-methylphenyl)-2-methylsulfanyl-6-pyridin-4-yl-pyrimidin-4-one Openeye Name: 3-methyl-2-methylsulfanyl-5-(m-tolyl)-6-(4-pyridyl)pyrimidin-4-one CAS Name: 3-methyl-5-(3-methylphenyl)-2-(methylthio)-6-pyridin-4-yl-4-pyrimidinone IUPAC Name: 3-methyl-5-(3-methylphenyl)-2-methylsulfanyl-6-pyridin-4-ylpyrimidin-4-one Traditional Name: 3-methyl-2-(methylthio)-5-(m-tolyl)-6-(4-pyridyl)pyrimidin-4-one Formula: C36H34N6O2S2 MolecularWeight: 646.82416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(N=C(N(C2=O)C)SC)C3=CC=NC=C3.CC1=CC=CC(=C1)C2=C(N=C(N(C2=O)C)SC)C3=CC=NC=C3

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(N=C(N(C2=O)C)SC)C3=CC=NC=C3.CC1=CC=CC(=C1)C2=C(N=C(N(C2=O)C)SC)C3=CC=NC=C3

InChI

InChI=1S/2C18H17N3OS/c2*1-12-5-4-6-14(11-12)15-16(13-7-9-19-10-8-13)20-18(23-3)21(2)17(15)22/h2*4-11H,1-3H3