N-tert-butyl-2-[4-cyclopropyl-1-(2-methylphenyl)-7-oxidanylidene-pyrazolo[3,4-d]pyridazin-6-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-cyclopropyl-1-(2-methylphenyl)-7-oxidanylidene-pyrazolo[3,4-d]pyridazin-6-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-cyclopropyl-1-(o-tolyl)-7-oxo-pyrazolo[3,4-d]pyridazin-6-yl]acetamide CAS Name: N-tert-butyl-2-[4-cyclopropyl-1-(2-methylphenyl)-7-oxo-6-pyrazolo[3,4-d]pyridazinyl]acetamide IUPAC Name: N-tert-butyl-2-[4-cyclopropyl-1-(2-methylphenyl)-7-oxopyrazolo[3,4-d]pyridazin-6-yl]acetamide Traditional Name: N-tert-butyl-2-[4-cyclopropyl-7-keto-1-(o-tolyl)pyrazolo[3,4-d]pyridazin-6-yl]acetamide Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C3=C(C=N2)C(=NN(C3=O)CC(=O)NC(C)(C)C)C4CC4

Isomeric SMILES

CC1=CC=CC=C1N2C3=C(C=N2)C(=NN(C3=O)CC(=O)NC(C)(C)C)C4CC4

InChI

InChI=1S/C21H25N5O2/c1-13-7-5-6-8-16(13)26-19-15(11-22-26)18(14-9-10-14)24-25(20(19)28)12-17(27)23-21(2,3)4/h5-8,11,14H,9-10,12H2,1-4H3,(H,23,27)