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

Systemtic Name: N-[3-cyano-1-(furan-2-ylmethyl)-4,5-diphenyl-pyrrol-2-yl]-4-fluoranyl-benzamide Openeye Name: N-[3-cyano-1-(2-furylmethyl)-4,5-diphenyl-pyrrol-2-yl]-4-fluoro-benzamide CAS Name: N-[3-cyano-1-(2-furanylmethyl)-4,5-diphenyl-2-pyrrolyl]-4-fluorobenzamide IUPAC Name: N-[3-cyano-1-(furan-2-ylmethyl)-4,5-diphenylpyrrol-2-yl]-4-fluorobenzamide Traditional Name: N-[3-cyano-1-(2-furfuryl)-4,5-diphenyl-pyrrol-2-yl]-4-fluoro-benzamide Formula: C29H20FN3O2 MolecularWeight: 461.486403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(C(=C2C#N)NC(=O)C3=CC=C(C=C3)F)CC4=CC=CO4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(C(=C2C#N)NC(=O)C3=CC=C(C=C3)F)CC4=CC=CO4)C5=CC=CC=C5

InChI

InChI=1S/C29H20FN3O2/c30-23-15-13-22(14-16-23)29(34)32-28-25(18-31)26(20-8-3-1-4-9-20)27(21-10-5-2-6-11-21)33(28)19-24-12-7-17-35-24/h1-17H,19H2,(H,32,34)