N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide CAS Name: N-(3-cyano-4,5-dimethyl-1-phenyl-2-pyrrolyl)-1-[(4-fluorophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(3-cyano-4,5-dimethyl-1-phenylpyrrol-2-yl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide Traditional Name: N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-1-(4-fluorobenzoyl)isonipecotamide Formula: C26H25FN4O2 MolecularWeight: 444.500703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4)C

InChI

InChI=1S/C26H25FN4O2/c1-17-18(2)31(22-6-4-3-5-7-22)24(23(17)16-28)29-25(32)19-12-14-30(15-13-19)26(33)20-8-10-21(27)11-9-20/h3-11,19H,12-15H2,1-2H3,(H,29,32)