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

Systemtic Name: N-(2-aminophenyl)-4-[3-cyano-5-[(3,3-dimethylpiperidin-1-yl)methyl]pyridin-2-yl]benzamide Openeye Name: N-(2-aminophenyl)-4-[3-cyano-5-[(3,3-dimethyl-1-piperidyl)methyl]-2-pyridyl]benzamide CAS Name: N-(2-aminophenyl)-4-[3-cyano-5-[(3,3-dimethyl-1-piperidinyl)methyl]-2-pyridinyl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[3-cyano-5-[(3,3-dimethylpiperidin-1-yl)methyl]pyridin-2-yl]benzamide Traditional Name: N-(2-aminophenyl)-4-[3-cyano-5-[(3,3-dimethylpiperidino)methyl]-2-pyridyl]benzamide Formula: C27H29N5O MolecularWeight: 439.55206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCN(C1)CC2=CN=C(C(=C2)C#N)C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N)C

Isomeric SMILES

CC1(CCCN(C1)CC2=CN=C(C(=C2)C#N)C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N)C

InChI

InChI=1S/C27H29N5O/c1-27(2)12-5-13-32(18-27)17-19-14-22(15-28)25(30-16-19)20-8-10-21(11-9-20)26(33)31-24-7-4-3-6-23(24)29/h3-4,6-11,14,16H,5,12-13,17-18,29H2,1-2H3,(H,31,33)