(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 1-butyl-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 1-butyl-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: [2-(2-thienyl)oxazol-4-yl]methyl 1-butyl-6-oxo-pyridazine-3-carboxylate CAS Name: 1-butyl-6-oxo-3-pyridazinecarboxylic acid (2-thiophen-2-yl-4-oxazolyl)methyl ester IUPAC Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 1-butyl-6-oxopyridazine-3-carboxylate Traditional Name: 1-butyl-6-keto-pyridazine-3-carboxylic acid [2-(2-thienyl)oxazol-4-yl]methyl ester Formula: C17H17N3O4S MolecularWeight: 359.39958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C=CC(=N1)C(=O)OCC2=COC(=N2)C3=CC=CS3

Isomeric SMILES

CCCCN1C(=O)C=CC(=N1)C(=O)OCC2=COC(=N2)C3=CC=CS3

InChI

InChI=1S/C17H17N3O4S/c1-2-3-8-20-15(21)7-6-13(19-20)17(22)24-11-12-10-23-16(18-12)14-5-4-9-25-14/h4-7,9-10H,2-3,8,11H2,1H3