N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-(4-nitroimidazol-1-yl)ethanamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-(4-nitroimidazol-1-yl)ethanamide Openeye Name: N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-(4-nitroimidazol-1-yl)acetamide CAS Name: N-(3-cyano-4,5-dimethyl-1-phenyl-2-pyrrolyl)-2-(4-nitro-1-imidazolyl)acetamide IUPAC Name: N-(3-cyano-4,5-dimethyl-1-phenylpyrrol-2-yl)-2-(4-nitroimidazol-1-yl)acetamide Traditional Name: N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-(4-nitroimidazol-1-yl)acetamide Formula: C18H16N6O3 MolecularWeight: 364.35804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CN2C=C(N=C2)[N+](=O)[O-])C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CN2C=C(N=C2)[N+](=O)[O-])C3=CC=CC=C3)C

InChI

InChI=1S/C18H16N6O3/c1-12-13(2)23(14-6-4-3-5-7-14)18(15(12)8-19)21-17(25)10-22-9-16(20-11-22)24(26)27/h3-7,9,11H,10H2,1-2H3,(H,21,25)