1-[[4-chloranyl-6-methyl-3-[(2-methyl-4-pyrazol-1-yl-quinolin-8-yl)oxymethyl]pyridin-2-yl]methyl]-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 1-[[4-chloranyl-6-methyl-3-[(2-methyl-4-pyrazol-1-yl-quinolin-8-yl)oxymethyl]pyridin-2-yl]methyl]-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 1-[[4-chloro-6-methyl-3-[(2-methyl-4-pyrazol-1-yl-8-quinolyl)oxymethyl]-2-pyridyl]methyl]-2-oxo-pyridine-3-carbonitrile CAS Name: 1-[[4-chloro-6-methyl-3-[[2-methyl-4-(1-pyrazolyl)-8-quinolinyl]oxymethyl]-2-pyridinyl]methyl]-2-oxo-3-pyridinecarbonitrile IUPAC Name: 1-[[4-chloro-6-methyl-3-[(2-methyl-4-pyrazol-1-ylquinolin-8-yl)oxymethyl]pyridin-2-yl]methyl]-2-oxopyridine-3-carbonitrile Traditional Name: 1-[[4-chloro-6-methyl-3-[(2-methyl-4-pyrazol-1-yl-8-quinolyl)oxymethyl]-2-pyridyl]methyl]-2-keto-nicotinonitrile Formula: C27H21ClN6O2 MolecularWeight: 496.94764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OCC3=C(N=C(C=C3Cl)C)CN4C=CC=C(C4=O)C#N)C(=C1)N5C=CC=N5

Isomeric SMILES

CC1=NC2=C(C=CC=C2OCC3=C(N=C(C=C3Cl)C)CN4C=CC=C(C4=O)C#N)C(=C1)N5C=CC=N5

InChI

InChI=1S/C27H21ClN6O2/c1-17-12-22(28)21(23(31-17)15-33-10-4-6-19(14-29)27(33)35)16-36-25-8-3-7-20-24(34-11-5-9-30-34)13-18(2)32-26(20)25/h3-13H,15-16H2,1-2H3