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

Systemtic Name: ethyl 4-[(4-tert-butylphenyl)amino]-3-cyano-5-methyl-pyrrolo[1,2-b]pyridazine-6-carboxylate Openeye Name: ethyl 4-(4-tert-butylanilino)-3-cyano-5-methyl-pyrrolo[1,2-b]pyridazine-6-carboxylate CAS Name: 4-(4-tert-butylanilino)-3-cyano-5-methyl-6-pyrrolo[1,2-b]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-tert-butylanilino)-3-cyano-5-methylpyrrolo[1,2-b]pyridazine-6-carboxylate Traditional Name: 4-(4-tert-butylanilino)-3-cyano-5-methyl-pyrrolo[1,2-b]pyridazine-6-carboxylic acid ethyl ester Formula: C22H24N4O2 MolecularWeight: 376.45156

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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)C(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O2/c1-6-28-21(27)18-13-26-20(14(18)2)19(15(11-23)12-24-26)25-17-9-7-16(8-10-17)22(3,4)5/h7-10,12-13,25H,6H2,1-5H3