3-cyano-N-[(3-methoxyphenyl)methyl]-5-methyl-4-[(4-phenoxyphenyl)amino]pyrrolo[1,2-b]pyridazine-6-carboxamide

Systemtic Name: 3-cyano-N-[(3-methoxyphenyl)methyl]-5-methyl-4-[(4-phenoxyphenyl)amino]pyrrolo[1,2-b]pyridazine-6-carboxamide Openeye Name: 3-cyano-N-[(3-methoxyphenyl)methyl]-5-methyl-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-6-carboxamide CAS Name: 3-cyano-N-[(3-methoxyphenyl)methyl]-5-methyl-4-(4-phenoxyanilino)-6-pyrrolo[1,2-b]pyridazinecarboxamide IUPAC Name: 3-cyano-N-[(3-methoxyphenyl)methyl]-5-methyl-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-6-carboxamide Traditional Name: 3-cyano-N-m-anisyl-5-methyl-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-6-carboxamide Formula: C30H25N5O3 MolecularWeight: 503.5512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=NN2C=C1C(=O)NCC3=CC(=CC=C3)OC)C#N)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CC1=C2C(=C(C=NN2C=C1C(=O)NCC3=CC(=CC=C3)OC)C#N)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C30H25N5O3/c1-20-27(30(36)32-17-21-7-6-10-26(15-21)37-2)19-35-29(20)28(22(16-31)18-33-35)34-23-11-13-25(14-12-23)38-24-8-4-3-5-9-24/h3-15,18-19,34H,17H2,1-2H3,(H,32,36)