oxolan-2-ylmethyl N-[3-cyano-5-methyl-4-[(4-phenoxyphenyl)amino]pyrrolo[1,2-b]pyridazin-6-yl]carbamate

Systemtic Name: oxolan-2-ylmethyl N-[3-cyano-5-methyl-4-[(4-phenoxyphenyl)amino]pyrrolo[1,2-b]pyridazin-6-yl]carbamate Openeye Name: tetrahydrofuran-2-ylmethyl N-[3-cyano-5-methyl-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazin-6-yl]carbamate CAS Name: N-[3-cyano-5-methyl-4-(4-phenoxyanilino)-6-pyrrolo[1,2-b]pyridazinyl]carbamic acid 2-oxolanylmethyl ester IUPAC Name: oxolan-2-ylmethyl N-[3-cyano-5-methyl-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazin-6-yl]carbamate Traditional Name: N-[3-cyano-5-methyl-4-(4-phenoxyanilino)pyrrolo[1,2-b]pyridazin-6-yl]carbamic acid tetrahydrofurfuryl ester Formula: C27H25N5O4 MolecularWeight: 483.5185

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=NN2C=C1NC(=O)OCC3CCCO3)C#N)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CC1=C2C(=C(C=NN2C=C1NC(=O)OCC3CCCO3)C#N)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C27H25N5O4/c1-18-24(31-27(33)35-17-23-8-5-13-34-23)16-32-26(18)25(19(14-28)15-29-32)30-20-9-11-22(12-10-20)36-21-6-3-2-4-7-21/h2-4,6-7,9-12,15-16,23,30H,5,8,13,17H2,1H3,(H,31,33)