3-methyl-2-[[4-[(3-methyl-1-oxidanylidene-isoquinolin-2-yl)amino]-6-phenylazanyl-1,3,5-triazin-2-yl]amino]isoquinolin-1-one

Systemtic Name: 3-methyl-2-[[4-[(3-methyl-1-oxidanylidene-isoquinolin-2-yl)amino]-6-phenylazanyl-1,3,5-triazin-2-yl]amino]isoquinolin-1-one Openeye Name: 2-[[4-anilino-6-[(3-methyl-1-oxo-2-isoquinolyl)amino]-1,3,5-triazin-2-yl]amino]-3-methyl-isoquinolin-1-one CAS Name: 2-[[4-anilino-6-[(3-methyl-1-oxo-2-isoquinolinyl)amino]-1,3,5-triazin-2-yl]amino]-3-methyl-1-isoquinolinone IUPAC Name: 2-[[4-anilino-6-[(3-methyl-1-oxoisoquinolin-2-yl)amino]-1,3,5-triazin-2-yl]amino]-3-methylisoquinolin-1-one Traditional Name: 2-[[4-anilino-6-[(1-keto-3-methyl-2-isoquinolyl)amino]-s-triazin-2-yl]amino]-3-methyl-isocarbostyril Formula: C29H24N8O2 MolecularWeight: 516.55326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2C(=O)N1NC3=NC(=NC(=N3)NC4=CC=CC=C4)NN5C(=CC6=CC=CC=C6C5=O)C

Isomeric SMILES

CC1=CC2=CC=CC=C2C(=O)N1NC3=NC(=NC(=N3)NC4=CC=CC=C4)NN5C(=CC6=CC=CC=C6C5=O)C

InChI

InChI=1S/C29H24N8O2/c1-18-16-20-10-6-8-14-23(20)25(38)36(18)34-28-31-27(30-22-12-4-3-5-13-22)32-29(33-28)35-37-19(2)17-21-11-7-9-15-24(21)26(37)39/h3-17H,1-2H3,(H3,30,31,32,33,34,35)