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

Systemtic Name: 6-methyl-5-[(2-methyl-5-nitro-phenyl)methyl]-2-(2-methylsulfanylethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 6-methyl-5-[(2-methyl-5-nitro-phenyl)methyl]-2-(2-methylsulfanylethylsulfanyl)-1H-pyrimidin-4-one CAS Name: 6-methyl-5-[(2-methyl-5-nitrophenyl)methyl]-2-[2-(methylthio)ethylthio]-1H-pyrimidin-4-one IUPAC Name: 6-methyl-5-[(2-methyl-5-nitrophenyl)methyl]-2-(2-methylsulfanylethylsulfanyl)-1H-pyrimidin-4-one Traditional Name: 6-methyl-5-(2-methyl-5-nitro-benzyl)-2-[2-(methylthio)ethylthio]-1H-pyrimidin-4-one Formula: C16H19N3O3S2 MolecularWeight: 365.47036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O3S2/c1-10-4-5-13(19(21)22)8-12(10)9-14-11(2)17-16(18-15(14)20)24-7-6-23-3/h4-5,8H,6-7,9H2,1-3H3,(H,17,18,20)