N-(4,5-dimethyl-2-nitro-phenyl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-(1-methylimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(4,5-dimethyl-2-nitrophenyl)-2-[(1-methyl-2-imidazolyl)thio]acetamide IUPAC Name: N-(4,5-dimethyl-2-nitrophenyl)-2-(1-methylimidazol-2-yl)sulfanylacetamide Traditional Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-[(1-methylimidazol-2-yl)thio]acetamide Formula: C14H16N4O3S MolecularWeight: 320.36684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC(=O)CSC2=NC=CN2C

Isomeric SMILES

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC(=O)CSC2=NC=CN2C

InChI

InChI=1S/C14H16N4O3S/c1-9-6-11(12(18(20)21)7-10(9)2)16-13(19)8-22-14-15-4-5-17(14)3/h4-7H,8H2,1-3H3,(H,16,19)