N-[3-cyano-4,5-diphenyl-1-(phenylmethyl)pyrrol-2-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[3-cyano-4,5-diphenyl-1-(phenylmethyl)pyrrol-2-yl]-4-fluoranyl-benzamide Openeye Name: N-(1-benzyl-3-cyano-4,5-diphenyl-pyrrol-2-yl)-4-fluoro-benzamide CAS Name: N-[3-cyano-4,5-diphenyl-1-(phenylmethyl)-2-pyrrolyl]-4-fluorobenzamide IUPAC Name: N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)-4-fluorobenzamide Traditional Name: N-(1-benzyl-3-cyano-4,5-diphenyl-pyrrol-2-yl)-4-fluoro-benzamide Formula: C31H22FN3O MolecularWeight: 471.524283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=C(C(=C2NC(=O)C3=CC=C(C=C3)F)C#N)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=C(C(=C2NC(=O)C3=CC=C(C=C3)F)C#N)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H22FN3O/c32-26-18-16-25(17-19-26)31(36)34-30-27(20-33)28(23-12-6-2-7-13-23)29(24-14-8-3-9-15-24)35(30)21-22-10-4-1-5-11-22/h1-19H,21H2,(H,34,36)