6-methyl-5-[(2-methyl-5-nitro-phenyl)methyl]-2-methylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-5-[(2-methyl-5-nitro-phenyl)methyl]-2-methylsulfanyl-1H-pyrimidin-4-one Openeye Name: 6-methyl-5-[(2-methyl-5-nitro-phenyl)methyl]-2-methylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-methyl-5-[(2-methyl-5-nitrophenyl)methyl]-2-(methylthio)-1H-pyrimidin-4-one IUPAC Name: 6-methyl-5-[(2-methyl-5-nitrophenyl)methyl]-2-methylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-methyl-5-(2-methyl-5-nitro-benzyl)-2-(methylthio)-1H-pyrimidin-4-one Formula: C14H15N3O3S MolecularWeight: 305.3522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])CC2=C(NC(=NC2=O)SC)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])CC2=C(NC(=NC2=O)SC)C

InChI

InChI=1S/C14H15N3O3S/c1-8-4-5-11(17(19)20)6-10(8)7-12-9(2)15-14(21-3)16-13(12)18/h4-6H,7H2,1-3H3,(H,15,16,18)