ethyl 4-(2-cyclopentylethanoylamino)-1-(4-fluorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-(2-cyclopentylethanoylamino)-1-(4-fluorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-[(2-cyclopentylacetyl)amino]-1-(4-fluorophenyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 4-[(2-cyclopentyl-1-oxoethyl)amino]-1-(4-fluorophenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-cyclopentylacetyl)amino]-1-(4-fluorophenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-[(2-cyclopentylacetyl)amino]-1-(4-fluorophenyl)-6-keto-pyridazine-3-carboxylic acid ethyl ester Formula: C20H22FN3O4 MolecularWeight: 387.404783

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)CC2CCCC2)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)CC2CCCC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FN3O4/c1-2-28-20(27)19-16(22-17(25)11-13-5-3-4-6-13)12-18(26)24(23-19)15-9-7-14(21)8-10-15/h7-10,12-13H,2-6,11H2,1H3,(H,22,25)