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

Systemtic Name: ethyl 3-cyano-5-methyl-4-[(4-phenylazanylphenyl)amino]pyrrolo[1,2-b]pyridazine-6-carboxylate Openeye Name: ethyl 4-(4-anilinoanilino)-3-cyano-5-methyl-pyrrolo[1,2-b]pyridazine-6-carboxylate CAS Name: 4-(4-anilinoanilino)-3-cyano-5-methyl-6-pyrrolo[1,2-b]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-anilinoanilino)-3-cyano-5-methylpyrrolo[1,2-b]pyridazine-6-carboxylate Traditional Name: 4-(4-anilinoanilino)-3-cyano-5-methyl-pyrrolo[1,2-b]pyridazine-6-carboxylic acid ethyl ester Formula: C24H21N5O2 MolecularWeight: 411.45584

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN2C(=C1C)C(=C(C=N2)C#N)NC3=CC=C(C=C3)NC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CN2C(=C1C)C(=C(C=N2)C#N)NC3=CC=C(C=C3)NC4=CC=CC=C4

InChI

InChI=1S/C24H21N5O2/c1-3-31-24(30)21-15-29-23(16(21)2)22(17(13-25)14-26-29)28-20-11-9-19(10-12-20)27-18-7-5-4-6-8-18/h4-12,14-15,27-28H,3H2,1-2H3