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

Systemtic Name: ethyl 3-cyano-5-methyl-4-[[1-(phenylmethyl)indazol-5-yl]amino]pyrrolo[1,2-b]pyridazine-6-carboxylate Openeye Name: ethyl 4-[(1-benzylindazol-5-yl)amino]-3-cyano-5-methyl-pyrrolo[1,2-b]pyridazine-6-carboxylate CAS Name: 3-cyano-5-methyl-4-[[1-(phenylmethyl)-5-indazolyl]amino]-6-pyrrolo[1,2-b]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(1-benzylindazol-5-yl)amino]-3-cyano-5-methylpyrrolo[1,2-b]pyridazine-6-carboxylate Traditional Name: 4-[(1-benzylindazol-5-yl)amino]-3-cyano-5-methyl-pyrrolo[1,2-b]pyridazine-6-carboxylic acid ethyl ester Formula: C26H22N6O2 MolecularWeight: 450.49188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN2C(=C1C)C(=C(C=N2)C#N)NC3=CC4=C(C=C3)N(N=C4)CC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=CN2C(=C1C)C(=C(C=N2)C#N)NC3=CC4=C(C=C3)N(N=C4)CC5=CC=CC=C5

InChI

InChI=1S/C26H22N6O2/c1-3-34-26(33)22-16-32-25(17(22)2)24(20(12-27)14-29-32)30-21-9-10-23-19(11-21)13-28-31(23)15-18-7-5-4-6-8-18/h4-11,13-14,16,30H,3,15H2,1-2H3