N-(2-aminophenyl)-4-[3-cyano-5-[(3-pyridin-2-ylpyrrolidin-1-yl)methyl]pyridin-2-yl]benzamide

Systemtic Name: N-(2-aminophenyl)-4-[3-cyano-5-[(3-pyridin-2-ylpyrrolidin-1-yl)methyl]pyridin-2-yl]benzamide Openeye Name: N-(2-aminophenyl)-4-[3-cyano-5-[[3-(2-pyridyl)pyrrolidin-1-yl]methyl]-2-pyridyl]benzamide CAS Name: N-(2-aminophenyl)-4-[3-cyano-5-[[3-(2-pyridinyl)-1-pyrrolidinyl]methyl]-2-pyridinyl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[3-cyano-5-[(3-pyridin-2-ylpyrrolidin-1-yl)methyl]pyridin-2-yl]benzamide Traditional Name: N-(2-aminophenyl)-4-[3-cyano-5-[[3-(2-pyridyl)pyrrolidino]methyl]-2-pyridyl]benzamide Formula: C29H26N6O MolecularWeight: 474.55634

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1C2=CC=CC=N2)CC3=CN=C(C(=C3)C#N)C4=CC=C(C=C4)C(=O)NC5=CC=CC=C5N

Isomeric SMILES

C1CN(CC1C2=CC=CC=N2)CC3=CN=C(C(=C3)C#N)C4=CC=C(C=C4)C(=O)NC5=CC=CC=C5N

InChI

InChI=1S/C29H26N6O/c30-16-24-15-20(18-35-14-12-23(19-35)26-6-3-4-13-32-26)17-33-28(24)21-8-10-22(11-9-21)29(36)34-27-7-2-1-5-25(27)31/h1-11,13,15,17,23H,12,14,18-19,31H2,(H,34,36)