N-(3-methylsulfanylphenyl)-2-(4-nitroimidazol-1-yl)ethanamide

Systemtic Name: N-(3-methylsulfanylphenyl)-2-(4-nitroimidazol-1-yl)ethanamide Openeye Name: N-(3-methylsulfanylphenyl)-2-(4-nitroimidazol-1-yl)acetamide CAS Name: N-[3-(methylthio)phenyl]-2-(4-nitro-1-imidazolyl)acetamide IUPAC Name: N-(3-methylsulfanylphenyl)-2-(4-nitroimidazol-1-yl)acetamide Traditional Name: N-[3-(methylthio)phenyl]-2-(4-nitroimidazol-1-yl)acetamide Formula: C12H12N4O3S MolecularWeight: 292.31368

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)CN2C=C(N=C2)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)CN2C=C(N=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O3S/c1-20-10-4-2-3-9(5-10)14-12(17)7-15-6-11(13-8-15)16(18)19/h2-6,8H,7H2,1H3,(H,14,17)