5-methyl-4-[(4-phenoxyphenyl)amino]-7-phenyl-pyrrolo[1,2-b]pyridazine-3-carbonitrile

Systemtic Name: 5-methyl-4-[(4-phenoxyphenyl)amino]-7-phenyl-pyrrolo[1,2-b]pyridazine-3-carbonitrile Openeye Name: 5-methyl-4-(4-phenoxyanilino)-7-phenyl-pyrrolo[1,2-b]pyridazine-3-carbonitrile CAS Name: 5-methyl-4-(4-phenoxyanilino)-7-phenyl-3-pyrrolo[1,2-b]pyridazinecarbonitrile IUPAC Name: 5-methyl-4-(4-phenoxyanilino)-7-phenylpyrrolo[1,2-b]pyridazine-3-carbonitrile Traditional Name: 5-methyl-4-(4-phenoxyanilino)-7-phenyl-pyrrolo[1,2-b]pyridazine-3-carbonitrile Formula: C27H20N4O MolecularWeight: 416.4739

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=NN2C(=C1)C3=CC=CC=C3)C#N)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CC1=C2C(=C(C=NN2C(=C1)C3=CC=CC=C3)C#N)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C27H20N4O/c1-19-16-25(20-8-4-2-5-9-20)31-27(19)26(21(17-28)18-29-31)30-22-12-14-24(15-13-22)32-23-10-6-3-7-11-23/h2-16,18,30H,1H3