N-(3-chloranyl-4-methoxy-phenyl)-5-methyl-3-(4-methylphenyl)-4-oxidanylidene-pyridazino[4,5-b]indole-1-carboxamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-5-methyl-3-(4-methylphenyl)-4-oxidanylidene-pyridazino[4,5-b]indole-1-carboxamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-5-methyl-4-oxo-3-(p-tolyl)pyridazino[4,5-b]indole-1-carboxamide CAS Name: N-(3-chloro-4-methoxyphenyl)-5-methyl-3-(4-methylphenyl)-4-oxo-1-pyridazino[4,5-b]indolecarboxamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-5-methyl-3-(4-methylphenyl)-4-oxopyridazino[4,5-b]indole-1-carboxamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-4-keto-5-methyl-3-(p-tolyl)pyridazin[4,5-b]indole-1-carboxamide Formula: C26H21ClN4O3 MolecularWeight: 472.92294

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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=CC(=C(C=C5)OC)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4N3C)C(=N2)C(=O)NC5=CC(=C(C=C5)OC)Cl

InChI

InChI=1S/C26H21ClN4O3/c1-15-8-11-17(12-9-15)31-26(33)24-22(18-6-4-5-7-20(18)30(24)2)23(29-31)25(32)28-16-10-13-21(34-3)19(27)14-16/h4-14H,1-3H3,(H,28,32)