2,2,2-tris(chloranyl)ethyl 3-methyl-4-(3-methyl-5-oxidanylidene-4H-1,4-thiazin-2-yl)-4H-pyridazine-1-carboxylate

Systemtic Name: 2,2,2-tris(chloranyl)ethyl 3-methyl-4-(3-methyl-5-oxidanylidene-4H-1,4-thiazin-2-yl)-4H-pyridazine-1-carboxylate Openeye Name: 2,2,2-trichloroethyl 3-methyl-4-(3-methyl-5-oxo-4H-1,4-thiazin-2-yl)-4H-pyridazine-1-carboxylate CAS Name: 3-methyl-4-(3-methyl-5-oxo-4H-1,4-thiazin-2-yl)-4H-pyridazine-1-carboxylic acid 2,2,2-trichloroethyl ester IUPAC Name: 2,2,2-trichloroethyl 3-methyl-4-(3-methyl-5-oxo-4H-1,4-thiazin-2-yl)-4H-pyridazine-1-carboxylate Traditional Name: 4-(5-keto-3-methyl-4H-1,4-thiazin-2-yl)-3-methyl-4H-pyridazine-1-carboxylic acid 2,2,2-trichloroethyl ester Formula: C13H14Cl3N3O3S MolecularWeight: 398.69256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=CC1C2=C(NC(=O)CS2)C)C(=O)OCC(Cl)(Cl)Cl

Isomeric SMILES

CC1=NN(C=CC1C2=C(NC(=O)CS2)C)C(=O)OCC(Cl)(Cl)Cl

InChI

InChI=1S/C13H14Cl3N3O3S/c1-7-9(11-8(2)17-10(20)5-23-11)3-4-19(18-7)12(21)22-6-13(14,15)16/h3-4,9H,5-6H2,1-2H3,(H,17,20)