2-(2-methyl-5-nitro-phenyl)sulfanyl-1H-pyrimidin-6-one

Systemtic Name: 2-(2-methyl-5-nitro-phenyl)sulfanyl-1H-pyrimidin-6-one Openeye Name: 2-(2-methyl-5-nitro-phenyl)sulfanyl-1H-pyrimidin-6-one CAS Name: 2-[(2-methyl-5-nitrophenyl)thio]-1H-pyrimidin-6-one IUPAC Name: 2-(2-methyl-5-nitrophenyl)sulfanyl-1H-pyrimidin-6-one Traditional Name: 2-[(2-methyl-5-nitro-phenyl)thio]-1H-pyrimidin-6-one Formula: C11H9N3O3S MolecularWeight: 263.27246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])SC2=NC=CC(=O)N2

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])SC2=NC=CC(=O)N2

InChI

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