N-(2-methoxy-5-nitro-phenyl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-2-(1-methylimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(2-methoxy-5-nitrophenyl)-2-[(1-methyl-2-imidazolyl)thio]acetamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-2-(1-methylimidazol-2-yl)sulfanylacetamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-2-[(1-methylimidazol-2-yl)thio]acetamide Formula: C13H14N4O4S MolecularWeight: 322.33966

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CN1C=CN=C1SCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C13H14N4O4S/c1-16-6-5-14-13(16)22-8-12(18)15-10-7-9(17(19)20)3-4-11(10)21-2/h3-7H,8H2,1-2H3,(H,15,18)