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

Systemtic Name: ethyl 3-cyano-5-methyl-4-[(5-phenoxypyridin-2-yl)amino]pyrrolo[1,2-b]pyridazine-6-carboxylate Openeye Name: ethyl 3-cyano-5-methyl-4-[(5-phenoxy-2-pyridyl)amino]pyrrolo[1,2-b]pyridazine-6-carboxylate CAS Name: 3-cyano-5-methyl-4-[(5-phenoxy-2-pyridinyl)amino]-6-pyrrolo[1,2-b]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-5-methyl-4-[(5-phenoxypyridin-2-yl)amino]pyrrolo[1,2-b]pyridazine-6-carboxylate Traditional Name: 3-cyano-5-methyl-4-[(5-phenoxy-2-pyridyl)amino]pyrrolo[1,2-b]pyridazine-6-carboxylic acid ethyl ester Formula: C23H19N5O3 MolecularWeight: 413.42866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19N5O3/c1-3-30-23(29)19-14-28-22(15(19)2)21(16(11-24)12-26-28)27-20-10-9-18(13-25-20)31-17-7-5-4-6-8-17/h4-10,12-14H,3H2,1-2H3,(H,25,27)