ethyl 5-ethyl-2-[(6-oxidanylidene-1-phenyl-4,5-dihydropyridazin-3-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[(6-oxidanylidene-1-phenyl-4,5-dihydropyridazin-3-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[(6-oxo-1-phenyl-4,5-dihydropyridazine-3-carbonyl)amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[oxo-(6-oxo-1-phenyl-4,5-dihydropyridazin-3-yl)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[(6-oxo-1-phenyl-4,5-dihydropyridazine-3-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[(6-keto-1-phenyl-4,5-dihydropyridazine-3-carbonyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=NN(C(=O)CC2)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=NN(C(=O)CC2)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C20H21N3O4S/c1-3-14-12-15(20(26)27-4-2)19(28-14)21-18(25)16-10-11-17(24)23(22-16)13-8-6-5-7-9-13/h5-9,12H,3-4,10-11H2,1-2H3,(H,21,25)