(5-methyl-2-propan-2-yl-cyclohexyl) 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-6-oxidanylidene-4,5-dihydropyridazine-3-carboxylate

Systemtic Name: (5-methyl-2-propan-2-yl-cyclohexyl) 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-6-oxidanylidene-4,5-dihydropyridazine-3-carboxylate Openeye Name: (2-isopropyl-5-methyl-cyclohexyl) 1-(1,1-dioxothiolan-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxylate CAS Name: 1-(1,1-dioxo-3-thiolanyl)-6-oxo-4,5-dihydropyridazine-3-carboxylic acid (5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) 1-(1,1-dioxothiolan-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxylate Traditional Name: 1-(1,1-diketothiolan-3-yl)-6-keto-4,5-dihydropyridazine-3-carboxylic acid (2-isopropyl-5-methyl-cyclohexyl) ester Formula: C19H30N2O5S MolecularWeight: 398.5169

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2=NN(C(=O)CC2)C3CCS(=O)(=O)C3)C(C)C

Isomeric SMILES

CC1CCC(C(C1)OC(=O)C2=NN(C(=O)CC2)C3CCS(=O)(=O)C3)C(C)C

InChI

InChI=1S/C19H30N2O5S/c1-12(2)15-5-4-13(3)10-17(15)26-19(23)16-6-7-18(22)21(20-16)14-8-9-27(24,25)11-14/h12-15,17H,4-11H2,1-3H3