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

Systemtic Name: 3-cyano-N-(1-ethylpiperidin-3-yl)-5-methyl-4-[(4-phenoxyphenyl)amino]pyrrolo[1,2-b]pyridazine-6-carboxamide Openeye Name: 3-cyano-N-(1-ethyl-3-piperidyl)-5-methyl-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-6-carboxamide CAS Name: 3-cyano-N-(1-ethyl-3-piperidinyl)-5-methyl-4-(4-phenoxyanilino)-6-pyrrolo[1,2-b]pyridazinecarboxamide IUPAC Name: 3-cyano-N-(1-ethylpiperidin-3-yl)-5-methyl-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-6-carboxamide Traditional Name: 3-cyano-N-(1-ethyl-3-piperidyl)-5-methyl-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazine-6-carboxamide Formula: C29H30N6O2 MolecularWeight: 494.5875

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC(C1)NC(=O)C2=CN3C(=C2C)C(=C(C=N3)C#N)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CCN1CCCC(C1)NC(=O)C2=CN3C(=C2C)C(=C(C=N3)C#N)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C29H30N6O2/c1-3-34-15-7-8-23(18-34)33-29(36)26-19-35-28(20(26)2)27(21(16-30)17-31-35)32-22-11-13-25(14-12-22)37-24-9-5-4-6-10-24/h4-6,9-14,17,19,23,32H,3,7-8,15,18H2,1-2H3,(H,33,36)