5-[8-[[4-chloranyl-2-[(3-cyano-2-oxidanylidene-pyridin-1-yl)methyl]pyridin-3-yl]methoxy]-2-methyl-quinolin-4-yl]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 5-[8-[[4-chloranyl-2-[(3-cyano-2-oxidanylidene-pyridin-1-yl)methyl]pyridin-3-yl]methoxy]-2-methyl-quinolin-4-yl]-1-methyl-pyrrole-2-carboxamide Openeye Name: 5-[8-[[4-chloro-2-[(3-cyano-2-oxo-1-pyridyl)methyl]-3-pyridyl]methoxy]-2-methyl-4-quinolyl]-1-methyl-pyrrole-2-carboxamide CAS Name: 5-[8-[[4-chloro-2-[(3-cyano-2-oxo-1-pyridinyl)methyl]-3-pyridinyl]methoxy]-2-methyl-4-quinolinyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 5-[8-[[4-chloro-2-[(3-cyano-2-oxopyridin-1-yl)methyl]pyridin-3-yl]methoxy]-2-methylquinolin-4-yl]-1-methylpyrrole-2-carboxamide Traditional Name: 5-[8-[[4-chloro-2-[(3-cyano-2-keto-1-pyridyl)methyl]-3-pyridyl]methoxy]-2-methyl-4-quinolyl]-1-methyl-pyrrole-2-carboxamide Formula: C29H23ClN6O3 MolecularWeight: 538.98432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OCC3=C(C=CN=C3CN4C=CC=C(C4=O)C#N)Cl)C(=C1)C5=CC=C(N5C)C(=O)N

Isomeric SMILES

CC1=NC2=C(C=CC=C2OCC3=C(C=CN=C3CN4C=CC=C(C4=O)C#N)Cl)C(=C1)C5=CC=C(N5C)C(=O)N

InChI

InChI=1S/C29H23ClN6O3/c1-17-13-20(24-8-9-25(28(32)37)35(24)2)19-6-3-7-26(27(19)34-17)39-16-21-22(30)10-11-33-23(21)15-36-12-4-5-18(14-31)29(36)38/h3-13H,15-16H2,1-2H3,(H2,32,37)