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

Systemtic Name: 2-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-(4-nitro-2-oxidanyl-phenyl)ethanamide Openeye Name: N-(2-hydroxy-4-nitro-phenyl)-2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-(2-hydroxy-4-nitrophenyl)-2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: N-(2-hydroxy-4-nitrophenyl)-2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: N-(2-hydroxy-4-nitro-phenyl)-2-[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]acetamide Formula: C13H12N4O5S MolecularWeight: 336.32318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C13H12N4O5S/c1-7-4-11(19)16-13(14-7)23-6-12(20)15-9-3-2-8(17(21)22)5-10(9)18/h2-5,18H,6H2,1H3,(H,15,20)(H,14,16,19)