2-chloranyl-4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-N-(pyridin-2-ylmethyl)quinoline-3-carboxamide

Systemtic Name: 2-chloranyl-4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-N-(pyridin-2-ylmethyl)quinoline-3-carboxamide Openeye Name: 2-chloro-4-[(3-chloro-4-methoxy-phenyl)methylamino]-6-cyano-N-(2-pyridylmethyl)quinoline-3-carboxamide CAS Name: 2-chloro-4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-N-(2-pyridinylmethyl)-3-quinolinecarboxamide IUPAC Name: 2-chloro-4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-N-(pyridin-2-ylmethyl)quinoline-3-carboxamide Traditional Name: 2-chloro-4-[(3-chloro-4-methoxy-benzyl)amino]-6-cyano-N-(2-pyridylmethyl)quinoline-3-carboxamide Formula: C25H19Cl2N5O2 MolecularWeight: 492.35666

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=C(C(=NC3=C2C=C(C=C3)C#N)Cl)C(=O)NCC4=CC=CC=N4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=C(C(=NC3=C2C=C(C=C3)C#N)Cl)C(=O)NCC4=CC=CC=N4)Cl

InChI

InChI=1S/C25H19Cl2N5O2/c1-34-21-8-6-16(11-19(21)26)13-30-23-18-10-15(12-28)5-7-20(18)32-24(27)22(23)25(33)31-14-17-4-2-3-9-29-17/h2-11H,13-14H2,1H3,(H,30,32)(H,31,33)