N-[3-cyano-1-(3-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]-2-imidazol-1-yl-ethanamide

Systemtic Name: N-[3-cyano-1-(3-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]-2-imidazol-1-yl-ethanamide Openeye Name: N-[3-cyano-1-(3-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]-2-imidazol-1-yl-acetamide CAS Name: N-[3-cyano-1-(3-fluorophenyl)-4,5-dimethyl-2-pyrrolyl]-2-(1-imidazolyl)acetamide IUPAC Name: N-[3-cyano-1-(3-fluorophenyl)-4,5-dimethylpyrrol-2-yl]-2-imidazol-1-ylacetamide Traditional Name: N-[3-cyano-1-(3-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]-2-imidazol-1-yl-acetamide Formula: C18H16FN5O MolecularWeight: 337.350943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CN2C=CN=C2)C3=CC(=CC=C3)F)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CN2C=CN=C2)C3=CC(=CC=C3)F)C

InChI

InChI=1S/C18H16FN5O/c1-12-13(2)24(15-5-3-4-14(19)8-15)18(16(12)9-20)22-17(25)10-23-7-6-21-11-23/h3-8,11H,10H2,1-2H3,(H,22,25)