5-methyl-3-(4-methylphenyl)-4-oxidanylidene-N-quinolin-3-yl-pyridazino[4,5-b]indole-1-carboxamide

Systemtic Name: 5-methyl-3-(4-methylphenyl)-4-oxidanylidene-N-quinolin-3-yl-pyridazino[4,5-b]indole-1-carboxamide Openeye Name: 5-methyl-4-oxo-3-(p-tolyl)-N-(3-quinolyl)pyridazino[4,5-b]indole-1-carboxamide CAS Name: 5-methyl-3-(4-methylphenyl)-4-oxo-N-(3-quinolinyl)-1-pyridazino[4,5-b]indolecarboxamide IUPAC Name: 5-methyl-3-(4-methylphenyl)-4-oxo-N-quinolin-3-ylpyridazino[4,5-b]indole-1-carboxamide Traditional Name: 4-keto-5-methyl-3-(p-tolyl)-N-(3-quinolyl)pyridazin[4,5-b]indole-1-carboxamide Formula: C28H21N5O2 MolecularWeight: 459.49864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4N3C)C(=N2)C(=O)NC5=CC6=CC=CC=C6N=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4N3C)C(=N2)C(=O)NC5=CC6=CC=CC=C6N=C5

InChI

InChI=1S/C28H21N5O2/c1-17-11-13-20(14-12-17)33-28(35)26-24(21-8-4-6-10-23(21)32(26)2)25(31-33)27(34)30-19-15-18-7-3-5-9-22(18)29-16-19/h3-16H,1-2H3,(H,30,34)