N-(4-methyl-2-nitro-phenyl)-2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-methyl-2-nitro-phenyl)-2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-(4-methyl-2-nitro-phenyl)-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-(4-methyl-2-nitrophenyl)-2-[(6-oxo-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: N-(4-methyl-2-nitrophenyl)-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: 2-[(6-keto-1H-pyrimidin-2-yl)thio]-N-(4-methyl-2-nitro-phenyl)acetamide Formula: C13H12N4O4S MolecularWeight: 320.32378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NC=CC(=O)N2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NC=CC(=O)N2)[N+](=O)[O-]

InChI

InChI=1S/C13H12N4O4S/c1-8-2-3-9(10(6-8)17(20)21)15-12(19)7-22-13-14-5-4-11(18)16-13/h2-6H,7H2,1H3,(H,15,19)(H,14,16,18)