8-[[5-chloranyl-2-[(1-ethyl-3-methyl-pyrazol-4-yl)amino]pyridin-4-yl]amino]-2-methyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 8-[[5-chloranyl-2-[(1-ethyl-3-methyl-pyrazol-4-yl)amino]pyridin-4-yl]amino]-2-methyl-3,4-dihydroisoquinolin-1-one Openeye Name: 8-[[5-chloro-2-[(1-ethyl-3-methyl-pyrazol-4-yl)amino]-4-pyridyl]amino]-2-methyl-3,4-dihydroisoquinolin-1-one CAS Name: 8-[[5-chloro-2-[(1-ethyl-3-methyl-4-pyrazolyl)amino]-4-pyridinyl]amino]-2-methyl-3,4-dihydroisoquinolin-1-one IUPAC Name: 8-[[5-chloro-2-[(1-ethyl-3-methylpyrazol-4-yl)amino]pyridin-4-yl]amino]-2-methyl-3,4-dihydroisoquinolin-1-one Traditional Name: 8-[[5-chloro-2-[(1-ethyl-3-methyl-pyrazol-4-yl)amino]-4-pyridyl]amino]-2-methyl-3,4-dihydroisocarbostyril Formula: C21H23ClN6O MolecularWeight: 410.89992

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)NC2=NC=C(C(=C2)NC3=CC=CC4=C3C(=O)N(CC4)C)Cl

Isomeric SMILES

CCN1C=C(C(=N1)C)NC2=NC=C(C(=C2)NC3=CC=CC4=C3C(=O)N(CC4)C)Cl

InChI

InChI=1S/C21H23ClN6O/c1-4-28-12-18(13(2)26-28)25-19-10-17(15(22)11-23-19)24-16-7-5-6-14-8-9-27(3)21(29)20(14)16/h5-7,10-12H,4,8-9H2,1-3H3,(H2,23,24,25)