N-[3-(1-tert-butylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-3-phenyl-benzamide

Systemtic Name: N-[3-(1-tert-butylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-3-phenyl-benzamide Openeye Name: N-[3-(1-tert-butyl-4-piperidyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-3-phenyl-benzamide CAS Name: N-[3-(1-tert-butyl-4-piperidinyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-3-phenylbenzamide IUPAC Name: N-[3-(1-tert-butylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-3-phenylbenzamide Traditional Name: N-[3-(1-tert-butyl-4-piperidyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-3-phenyl-benzamide Formula: C29H32N4O MolecularWeight: 452.59058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CCC(CC1)C2=CNC3=C2N=C(C=C3)NC(=O)C4=CC=CC(=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)N1CCC(CC1)C2=CNC3=C2N=C(C=C3)NC(=O)C4=CC=CC(=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H32N4O/c1-29(2,3)33-16-14-21(15-17-33)24-19-30-25-12-13-26(31-27(24)25)32-28(34)23-11-7-10-22(18-23)20-8-5-4-6-9-20/h4-13,18-19,21,30H,14-17H2,1-3H3,(H,31,32,34)