6-methyl-2-(4-nitrophenyl)sulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-2-(4-nitrophenyl)sulfanyl-1H-pyrimidin-4-one Openeye Name: 6-methyl-2-(4-nitrophenyl)sulfanyl-1H-pyrimidin-4-one CAS Name: 6-methyl-2-[(4-nitrophenyl)thio]-1H-pyrimidin-4-one IUPAC Name: 6-methyl-2-(4-nitrophenyl)sulfanyl-1H-pyrimidin-4-one Traditional Name: 6-methyl-2-[(4-nitrophenyl)thio]-1H-pyrimidin-4-one Formula: C11H9N3O3S MolecularWeight: 263.27246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9N3O3S/c1-7-6-10(15)13-11(12-7)18-9-4-2-8(3-5-9)14(16)17/h2-6H,1H3,(H,12,13,15)