2-(3-methoxy-4-nitro-phenyl)sulfanyl-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-(3-methoxy-4-nitro-phenyl)sulfanyl-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-(3-methoxy-4-nitro-phenyl)sulfanyl-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[(3-methoxy-4-nitrophenyl)thio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-(3-methoxy-4-nitrophenyl)sulfanyl-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[(3-methoxy-4-nitro-phenyl)thio]-6-methyl-1H-pyrimidin-4-one Formula: C12H11N3O4S MolecularWeight: 293.29844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SC2=CC(=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC(=O)N=C(N1)SC2=CC(=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C12H11N3O4S/c1-7-5-11(16)14-12(13-7)20-8-3-4-9(15(17)18)10(6-8)19-2/h3-6H,1-2H3,(H,13,14,16)