N-(2-bromanyl-4-methyl-phenyl)-3-(4-methoxyphenyl)-5-methyl-4-oxidanylidene-pyridazino[4,5-b]indole-1-carboxamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-3-(4-methoxyphenyl)-5-methyl-4-oxidanylidene-pyridazino[4,5-b]indole-1-carboxamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-3-(4-methoxyphenyl)-5-methyl-4-oxo-pyridazino[4,5-b]indole-1-carboxamide CAS Name: N-(2-bromo-4-methylphenyl)-3-(4-methoxyphenyl)-5-methyl-4-oxo-1-pyridazino[4,5-b]indolecarboxamide IUPAC Name: N-(2-bromo-4-methylphenyl)-3-(4-methoxyphenyl)-5-methyl-4-oxopyridazino[4,5-b]indole-1-carboxamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-4-keto-3-(4-methoxyphenyl)-5-methyl-pyridazin[4,5-b]indole-1-carboxamide Formula: C26H21BrN4O3 MolecularWeight: 517.37394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=NN(C(=O)C3=C2C4=CC=CC=C4N3C)C5=CC=C(C=C5)OC)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=NN(C(=O)C3=C2C4=CC=CC=C4N3C)C5=CC=C(C=C5)OC)Br

InChI

InChI=1S/C26H21BrN4O3/c1-15-8-13-20(19(27)14-15)28-25(32)23-22-18-6-4-5-7-21(18)30(2)24(22)26(33)31(29-23)16-9-11-17(34-3)12-10-16/h4-14H,1-3H3,(H,28,32)