2-(1-methylimidazol-2-yl)sulfanyl-N-(4-methyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-(1-methylimidazol-2-yl)sulfanyl-N-(4-methyl-3-nitro-phenyl)ethanamide Openeye Name: 2-(1-methylimidazol-2-yl)sulfanyl-N-(4-methyl-3-nitro-phenyl)acetamide CAS Name: 2-[(1-methyl-2-imidazolyl)thio]-N-(4-methyl-3-nitrophenyl)acetamide IUPAC Name: 2-(1-methylimidazol-2-yl)sulfanyl-N-(4-methyl-3-nitrophenyl)acetamide Traditional Name: 2-[(1-methylimidazol-2-yl)thio]-N-(4-methyl-3-nitro-phenyl)acetamide Formula: C13H14N4O3S MolecularWeight: 306.34026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NC=CN2C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NC=CN2C)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O3S/c1-9-3-4-10(7-11(9)17(19)20)15-12(18)8-21-13-14-5-6-16(13)2/h3-7H,8H2,1-2H3,(H,15,18)