butyl 4-[[5-methyl-1-(6-oxidanylidene-1H-pyridazin-3-yl)pyrazol-4-yl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[5-methyl-1-(6-oxidanylidene-1H-pyridazin-3-yl)pyrazol-4-yl]carbonylamino]benzoate Openeye Name: butyl 4-[[5-methyl-1-(6-oxo-1H-pyridazin-3-yl)pyrazole-4-carbonyl]amino]benzoate CAS Name: 4-[[[5-methyl-1-(6-oxo-1H-pyridazin-3-yl)-4-pyrazolyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[5-methyl-1-(6-oxo-1H-pyridazin-3-yl)pyrazole-4-carbonyl]amino]benzoate Traditional Name: 4-[[1-(6-keto-1H-pyridazin-3-yl)-5-methyl-pyrazole-4-carbonyl]amino]benzoic acid butyl ester Formula: C20H21N5O4 MolecularWeight: 395.41184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(N(N=C2)C3=NNC(=O)C=C3)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(N(N=C2)C3=NNC(=O)C=C3)C

InChI

InChI=1S/C20H21N5O4/c1-3-4-11-29-20(28)14-5-7-15(8-6-14)22-19(27)16-12-21-25(13(16)2)17-9-10-18(26)24-23-17/h5-10,12H,3-4,11H2,1-2H3,(H,22,27)(H,24,26)