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

Systemtic Name: 3-cyano-5-methyl-N-(3-morpholin-4-ylpropyl)-4-[(4-phenoxyphenyl)amino]pyrrolo[1,2-b]pyridazine-6-carboxamide Openeye Name: 3-cyano-5-methyl-N-(3-morpholinopropyl)-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-6-carboxamide CAS Name: 3-cyano-5-methyl-N-[3-(4-morpholinyl)propyl]-4-(4-phenoxyanilino)-6-pyrrolo[1,2-b]pyridazinecarboxamide IUPAC Name: 3-cyano-5-methyl-N-(3-morpholin-4-ylpropyl)-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-6-carboxamide Traditional Name: 3-cyano-5-methyl-N-(3-morpholinopropyl)-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-6-carboxamide Formula: C29H30N6O3 MolecularWeight: 510.5869

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=NN2C=C1C(=O)NCCCN3CCOCC3)C#N)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CC1=C2C(=C(C=NN2C=C1C(=O)NCCCN3CCOCC3)C#N)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C29H30N6O3/c1-21-26(29(36)31-12-5-13-34-14-16-37-17-15-34)20-35-28(21)27(22(18-30)19-32-35)33-23-8-10-25(11-9-23)38-24-6-3-2-4-7-24/h2-4,6-11,19-20,33H,5,12-17H2,1H3,(H,31,36)