1-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(2-ethoxypyridin-3-yl)methyl]-6-oxidanylidene-4,5-dihydropyridazine-3-carboxamide

Systemtic Name: 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(2-ethoxypyridin-3-yl)methyl]-6-oxidanylidene-4,5-dihydropyridazine-3-carboxamide Openeye Name: 1-(1,1-dioxothiolan-3-yl)-N-[(2-ethoxy-3-pyridyl)methyl]-6-oxo-4,5-dihydropyridazine-3-carboxamide CAS Name: 1-(1,1-dioxo-3-thiolanyl)-N-[(2-ethoxy-3-pyridinyl)methyl]-6-oxo-4,5-dihydropyridazine-3-carboxamide IUPAC Name: 1-(1,1-dioxothiolan-3-yl)-N-[(2-ethoxypyridin-3-yl)methyl]-6-oxo-4,5-dihydropyridazine-3-carboxamide Traditional Name: 1-(1,1-diketothiolan-3-yl)-N-[(2-ethoxy-3-pyridyl)methyl]-6-keto-4,5-dihydropyridazine-3-carboxamide Formula: C17H22N4O5S MolecularWeight: 394.44538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)CNC(=O)C2=NN(C(=O)CC2)C3CCS(=O)(=O)C3

Isomeric SMILES

CCOC1=C(C=CC=N1)CNC(=O)C2=NN(C(=O)CC2)C3CCS(=O)(=O)C3

InChI

InChI=1S/C17H22N4O5S/c1-2-26-17-12(4-3-8-18-17)10-19-16(23)14-5-6-15(22)21(20-14)13-7-9-27(24,25)11-13/h3-4,8,13H,2,5-7,9-11H2,1H3,(H,19,23)