ethyl 3-cyano-5-methyl-4-[(2-methyl-4-phenoxy-phenyl)amino]pyrrolo[1,2-b]pyridazine-6-carboxylate

Systemtic Name: ethyl 3-cyano-5-methyl-4-[(2-methyl-4-phenoxy-phenyl)amino]pyrrolo[1,2-b]pyridazine-6-carboxylate Openeye Name: ethyl 3-cyano-5-methyl-4-(2-methyl-4-phenoxy-anilino)pyrrolo[1,2-b]pyridazine-6-carboxylate CAS Name: 3-cyano-5-methyl-4-(2-methyl-4-phenoxyanilino)-6-pyrrolo[1,2-b]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-5-methyl-4-(2-methyl-4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-6-carboxylate Traditional Name: 3-cyano-5-methyl-4-(2-methyl-4-phenoxy-anilino)pyrrolo[1,2-b]pyridazine-6-carboxylic acid ethyl ester Formula: C25H22N4O3 MolecularWeight: 426.46718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN2C(=C1C)C(=C(C=N2)C#N)NC3=C(C=C(C=C3)OC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=CN2C(=C1C)C(=C(C=N2)C#N)NC3=C(C=C(C=C3)OC4=CC=CC=C4)C

InChI

InChI=1S/C25H22N4O3/c1-4-31-25(30)21-15-29-24(17(21)3)23(18(13-26)14-27-29)28-22-11-10-20(12-16(22)2)32-19-8-6-5-7-9-19/h5-12,14-15,28H,4H2,1-3H3