N-[(4-methylphenyl)-thiophen-2-yl-methyl]-2-(4-nitroimidazol-1-yl)ethanamide

Systemtic Name: N-[(4-methylphenyl)-thiophen-2-yl-methyl]-2-(4-nitroimidazol-1-yl)ethanamide Openeye Name: 2-(4-nitroimidazol-1-yl)-N-[p-tolyl(2-thienyl)methyl]acetamide CAS Name: N-[(4-methylphenyl)-thiophen-2-ylmethyl]-2-(4-nitro-1-imidazolyl)acetamide IUPAC Name: N-[(4-methylphenyl)-thiophen-2-ylmethyl]-2-(4-nitroimidazol-1-yl)acetamide Traditional Name: 2-(4-nitroimidazol-1-yl)-N-[p-tolyl(2-thienyl)methyl]acetamide Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CN3C=C(N=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CN3C=C(N=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O3S/c1-12-4-6-13(7-5-12)17(14-3-2-8-25-14)19-16(22)10-20-9-15(18-11-20)21(23)24/h2-9,11,17H,10H2,1H3,(H,19,22)