3-[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-quinolin-3-yl]-N-(pyridin-2-ylmethyl)propanamide

Systemtic Name: 3-[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-quinolin-3-yl]-N-(pyridin-2-ylmethyl)propanamide Openeye Name: 3-[4-[(3-chloro-4-methoxy-phenyl)methylamino]-6-cyano-3-quinolyl]-N-(2-pyridylmethyl)propanamide CAS Name: 3-[4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-3-quinolinyl]-N-(2-pyridinylmethyl)propanamide IUPAC Name: 3-[4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyanoquinolin-3-yl]-N-(pyridin-2-ylmethyl)propanamide Traditional Name: 3-[4-[(3-chloro-4-methoxy-benzyl)amino]-6-cyano-3-quinolyl]-N-(2-pyridylmethyl)propionamide Formula: C27H24ClN5O2 MolecularWeight: 485.96476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=C3C=C(C=CC3=NC=C2CCC(=O)NCC4=CC=CC=N4)C#N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=C3C=C(C=CC3=NC=C2CCC(=O)NCC4=CC=CC=N4)C#N)Cl

InChI

InChI=1S/C27H24ClN5O2/c1-35-25-9-6-19(13-23(25)28)15-33-27-20(16-31-24-8-5-18(14-29)12-22(24)27)7-10-26(34)32-17-21-4-2-3-11-30-21/h2-6,8-9,11-13,16H,7,10,15,17H2,1H3,(H,31,33)(H,32,34)