7-chloranyl-3-(3,5-dimethylphenyl)-N-(2,6-dimethylpyrimidin-4-yl)-2-oxidanylidene-4-(2-piperidin-2-ylethoxy)-1H-quinoline-6-carboxamide

Systemtic Name: 7-chloranyl-3-(3,5-dimethylphenyl)-N-(2,6-dimethylpyrimidin-4-yl)-2-oxidanylidene-4-(2-piperidin-2-ylethoxy)-1H-quinoline-6-carboxamide Openeye Name: 7-chloro-3-(3,5-dimethylphenyl)-N-(2,6-dimethylpyrimidin-4-yl)-2-oxo-4-[2-(2-piperidyl)ethoxy]-1H-quinoline-6-carboxamide CAS Name: 7-chloro-3-(3,5-dimethylphenyl)-N-(2,6-dimethyl-4-pyrimidinyl)-2-oxo-4-[2-(2-piperidinyl)ethoxy]-1H-quinoline-6-carboxamide IUPAC Name: 7-chloro-3-(3,5-dimethylphenyl)-N-(2,6-dimethylpyrimidin-4-yl)-2-oxo-4-(2-piperidin-2-ylethoxy)-1H-quinoline-6-carboxamide Traditional Name: 7-chloro-3-(3,5-dimethylphenyl)-N-(2,6-dimethylpyrimidin-4-yl)-2-keto-4-[2-(2-piperidyl)ethoxy]-1H-quinoline-6-carboxamide Formula: C31H34ClN5O3 MolecularWeight: 560.08636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=C(C3=CC(=C(C=C3NC2=O)Cl)C(=O)NC4=NC(=NC(=C4)C)C)OCCC5CCCCN5)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=C(C3=CC(=C(C=C3NC2=O)Cl)C(=O)NC4=NC(=NC(=C4)C)C)OCCC5CCCCN5)C

InChI

InChI=1S/C31H34ClN5O3/c1-17-11-18(2)13-21(12-17)28-29(40-10-8-22-7-5-6-9-33-22)24-15-23(25(32)16-26(24)36-31(28)39)30(38)37-27-14-19(3)34-20(4)35-27/h11-16,22,33H,5-10H2,1-4H3,(H,36,39)(H,34,35,37,38)