methyl 2-tert-butyl-3-oxidanylidene-5-(pyridin-4-ylmethylamino)pyridazine-4-carboxylate

Systemtic Name: methyl 2-tert-butyl-3-oxidanylidene-5-(pyridin-4-ylmethylamino)pyridazine-4-carboxylate Openeye Name: methyl 2-tert-butyl-3-oxo-5-(4-pyridylmethylamino)pyridazine-4-carboxylate CAS Name: 2-tert-butyl-3-oxo-5-(pyridin-4-ylmethylamino)-4-pyridazinecarboxylic acid methyl ester IUPAC Name: methyl 2-tert-butyl-3-oxo-5-(pyridin-4-ylmethylamino)pyridazine-4-carboxylate Traditional Name: 2-tert-butyl-3-keto-5-(4-pyridylmethylamino)pyridazine-4-carboxylic acid methyl ester Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C(=C(C=N1)NCC2=CC=NC=C2)C(=O)OC

Isomeric SMILES

CC(C)(C)N1C(=O)C(=C(C=N1)NCC2=CC=NC=C2)C(=O)OC

InChI

InChI=1S/C16H20N4O3/c1-16(2,3)20-14(21)13(15(22)23-4)12(10-19-20)18-9-11-5-7-17-8-6-11/h5-8,10,18H,9H2,1-4H3