N-[3-[(tert-butylamino)methyl]-5-[(7-chloranylquinolin-4-yl)amino]phenyl]-2-piperidin-1-yl-ethanamide

Systemtic Name: N-[3-[(tert-butylamino)methyl]-5-[(7-chloranylquinolin-4-yl)amino]phenyl]-2-piperidin-1-yl-ethanamide Openeye Name: N-[3-[(tert-butylamino)methyl]-5-[(7-chloro-4-quinolyl)amino]phenyl]-2-(1-piperidyl)acetamide CAS Name: N-[3-[(tert-butylamino)methyl]-5-[(7-chloro-4-quinolinyl)amino]phenyl]-2-(1-piperidinyl)acetamide IUPAC Name: N-[3-[(tert-butylamino)methyl]-5-[(7-chloroquinolin-4-yl)amino]phenyl]-2-piperidin-1-ylacetamide Traditional Name: N-[3-[(tert-butylamino)methyl]-5-[(7-chloro-4-quinolyl)amino]phenyl]-2-piperidino-acetamide Formula: C27H34ClN5O MolecularWeight: 480.04476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC1=CC(=CC(=C1)NC(=O)CN2CCCCC2)NC3=C4C=CC(=CC4=NC=C3)Cl

Isomeric SMILES

CC(C)(C)NCC1=CC(=CC(=C1)NC(=O)CN2CCCCC2)NC3=C4C=CC(=CC4=NC=C3)Cl

InChI

InChI=1S/C27H34ClN5O/c1-27(2,3)30-17-19-13-21(31-24-9-10-29-25-15-20(28)7-8-23(24)25)16-22(14-19)32-26(34)18-33-11-5-4-6-12-33/h7-10,13-16,30H,4-6,11-12,17-18H2,1-3H3,(H,29,31)(H,32,34)