N-[3-cyano-1-[(4-fluorophenyl)methyl]-4,5-dimethyl-pyrrol-2-yl]-2-(5-nitro-2-oxidanylidene-pyridin-1-yl)ethanamide

Systemtic Name: N-[3-cyano-1-[(4-fluorophenyl)methyl]-4,5-dimethyl-pyrrol-2-yl]-2-(5-nitro-2-oxidanylidene-pyridin-1-yl)ethanamide Openeye Name: N-[3-cyano-1-[(4-fluorophenyl)methyl]-4,5-dimethyl-pyrrol-2-yl]-2-(5-nitro-2-oxo-1-pyridyl)acetamide CAS Name: N-[3-cyano-1-[(4-fluorophenyl)methyl]-4,5-dimethyl-2-pyrrolyl]-2-(5-nitro-2-oxo-1-pyridinyl)acetamide IUPAC Name: N-[3-cyano-1-[(4-fluorophenyl)methyl]-4,5-dimethylpyrrol-2-yl]-2-(5-nitro-2-oxopyridin-1-yl)acetamide Traditional Name: N-[3-cyano-1-(4-fluorobenzyl)-4,5-dimethyl-pyrrol-2-yl]-2-(2-keto-5-nitro-1-pyridyl)acetamide Formula: C21H18FN5O4 MolecularWeight: 423.397123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CN2C=C(C=CC2=O)[N+](=O)[O-])CC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CN2C=C(C=CC2=O)[N+](=O)[O-])CC3=CC=C(C=C3)F)C

InChI

InChI=1S/C21H18FN5O4/c1-13-14(2)26(10-15-3-5-16(22)6-4-15)21(18(13)9-23)24-19(28)12-25-11-17(27(30)31)7-8-20(25)29/h3-8,11H,10,12H2,1-2H3,(H,24,28)