5-methyl-4-[(4-phenoxyphenyl)amino]-6-phenylazanyl-pyrrolo[1,2-b]pyridazine-3-carbonitrile

Systemtic Name: 5-methyl-4-[(4-phenoxyphenyl)amino]-6-phenylazanyl-pyrrolo[1,2-b]pyridazine-3-carbonitrile Openeye Name: 6-anilino-5-methyl-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-3-carbonitrile CAS Name: 6-anilino-5-methyl-4-(4-phenoxyanilino)-3-pyrrolo[1,2-b]pyridazinecarbonitrile IUPAC Name: 6-anilino-5-methyl-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-3-carbonitrile Traditional Name: 6-anilino-5-methyl-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-3-carbonitrile Formula: C27H21N5O MolecularWeight: 431.48854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=NN2C=C1NC3=CC=CC=C3)C#N)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CC1=C2C(=C(C=NN2C=C1NC3=CC=CC=C3)C#N)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C27H21N5O/c1-19-25(30-21-8-4-2-5-9-21)18-32-27(19)26(20(16-28)17-29-32)31-22-12-14-24(15-13-22)33-23-10-6-3-7-11-23/h2-15,17-18,30-31H,1H3