6-[(3-azanylpyridin-4-yl)amino]-5,8-dimethyl-2H-isoquinolin-1-one

Systemtic Name: 6-[(3-azanylpyridin-4-yl)amino]-5,8-dimethyl-2H-isoquinolin-1-one Openeye Name: 6-[(3-amino-4-pyridyl)amino]-5,8-dimethyl-2H-isoquinolin-1-one CAS Name: 6-[(3-amino-4-pyridinyl)amino]-5,8-dimethyl-2H-isoquinolin-1-one IUPAC Name: 6-[(3-aminopyridin-4-yl)amino]-5,8-dimethyl-2H-isoquinolin-1-one Traditional Name: 6-[(3-amino-4-pyridyl)amino]-5,8-dimethyl-isocarbostyril Formula: C16H16N4O MolecularWeight: 280.32444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1C(=O)NC=C2)C)NC3=C(C=NC=C3)N

Isomeric SMILES

CC1=CC(=C(C2=C1C(=O)NC=C2)C)NC3=C(C=NC=C3)N

InChI

InChI=1S/C16H16N4O/c1-9-7-14(20-13-4-5-18-8-12(13)17)10(2)11-3-6-19-16(21)15(9)11/h3-8H,17H2,1-2H3,(H,18,20)(H,19,21)