ethyl 3-cyano-5-(1-methoxypropan-2-yloxymethyl)-4-[(4-phenoxyphenyl)amino]pyrrolo[1,2-b]pyridazine-6-carboxylate

Systemtic Name: ethyl 3-cyano-5-(1-methoxypropan-2-yloxymethyl)-4-[(4-phenoxyphenyl)amino]pyrrolo[1,2-b]pyridazine-6-carboxylate Openeye Name: ethyl 3-cyano-5-[(2-methoxy-1-methyl-ethoxy)methyl]-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-6-carboxylate CAS Name: 3-cyano-5-(1-methoxypropan-2-yloxymethyl)-4-(4-phenoxyanilino)-6-pyrrolo[1,2-b]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-5-(1-methoxypropan-2-yloxymethyl)-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-6-carboxylate Traditional Name: 3-cyano-5-[(2-methoxy-1-methyl-ethoxy)methyl]-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-6-carboxylic acid ethyl ester Formula: C28H28N4O5 MolecularWeight: 500.54572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN2C(=C1COC(C)COC)C(=C(C=N2)C#N)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CN2C(=C1COC(C)COC)C(=C(C=N2)C#N)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C28H28N4O5/c1-4-35-28(33)24-16-32-27(25(24)18-36-19(2)17-34-3)26(20(14-29)15-30-32)31-21-10-12-23(13-11-21)37-22-8-6-5-7-9-22/h5-13,15-16,19,31H,4,17-18H2,1-3H3