[1-[4-chloranyl-2-(6-sulfanylidene-1H-pyridazin-3-yl)phenoxy]-4-oxidanylidene-pentan-2-yl] ethanoate

Systemtic Name: [1-[4-chloranyl-2-(6-sulfanylidene-1H-pyridazin-3-yl)phenoxy]-4-oxidanylidene-pentan-2-yl] ethanoate Openeye Name: [1-[[4-chloro-2-(6-thioxo-1H-pyridazin-3-yl)phenoxy]methyl]-3-oxo-butyl] acetate CAS Name: acetic acid [1-[4-chloro-2-(6-sulfanylidene-1H-pyridazin-3-yl)phenoxy]-4-oxopentan-2-yl] ester IUPAC Name: [1-[4-chloro-2-(6-sulfanylidene-1H-pyridazin-3-yl)phenoxy]-4-oxopentan-2-yl] acetate Traditional Name: acetic acid [1-[[4-chloro-2-(6-thioxo-1H-pyridazin-3-yl)phenoxy]methyl]-3-keto-butyl] ester Formula: C17H17ClN2O4S MolecularWeight: 380.84588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(COC1=C(C=C(C=C1)Cl)C2=NNC(=S)C=C2)OC(=O)C

Isomeric SMILES

CC(=O)CC(COC1=C(C=C(C=C1)Cl)C2=NNC(=S)C=C2)OC(=O)C

InChI

InChI=1S/C17H17ClN2O4S/c1-10(21)7-13(24-11(2)22)9-23-16-5-3-12(18)8-14(16)15-4-6-17(25)20-19-15/h3-6,8,13H,7,9H2,1-2H3,(H,20,25)