7-chloranyl-3-(3,5-dimethylphenyl)-4-[2-[(2S)-6-ethylpiperidin-2-yl]ethoxy]-2-oxidanylidene-N-pyrimidin-4-yl-1H-quinoline-6-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC(N1)CCOC2=C(C(=O)NC3=CC(=C(C=C32)C(=O)NC4=NC=NC=C4)Cl)C5=CC(=CC(=C5)C)C

Isomeric SMILES

CCC1CCC[C@H](N1)CCOC2=C(C(=O)NC3=CC(=C(C=C32)C(=O)NC4=NC=NC=C4)Cl)C5=CC(=CC(=C5)C)C

InChI

InChI=1S/C31H34ClN5O3/c1-4-21-6-5-7-22(35-21)9-11-40-29-24-15-23(30(38)37-27-8-10-33-17-34-27)25(32)16-26(24)36-31(39)28(29)20-13-18(2)12-19(3)14-20/h8,10,12-17,21-22,35H,4-7,9,11H2,1-3H3,(H,36,39)(H,33,34,37,38)/t21?,22-/m0/s1