[5-[(3-chloranyl-2-methyl-phenyl)sulfonylamino]-1,2,4-thiadiazol-3-yl] 2-oxidanylidenebutanoate

Systemtic Name: [5-[(3-chloranyl-2-methyl-phenyl)sulfonylamino]-1,2,4-thiadiazol-3-yl] 2-oxidanylidenebutanoate Openeye Name: [5-[(3-chloro-2-methyl-phenyl)sulfonylamino]-1,2,4-thiadiazol-3-yl] 2-oxobutanoate CAS Name: 2-oxobutanoic acid [5-[(3-chloro-2-methylphenyl)sulfonylamino]-1,2,4-thiadiazol-3-yl] ester IUPAC Name: [5-[(3-chloro-2-methylphenyl)sulfonylamino]-1,2,4-thiadiazol-3-yl] 2-oxobutanoate Traditional Name: 2-ketobutyric acid [5-[(3-chloro-2-methyl-phenyl)sulfonylamino]-1,2,4-thiadiazol-3-yl] ester Formula: C13H12ClN3O5S2 MolecularWeight: 389.83448

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(=O)OC1=NSC(=N1)NS(=O)(=O)C2=C(C(=CC=C2)Cl)C

Isomeric SMILES

CCC(=O)C(=O)OC1=NSC(=N1)NS(=O)(=O)C2=C(C(=CC=C2)Cl)C

InChI

InChI=1S/C13H12ClN3O5S2/c1-3-9(18)11(19)22-12-15-13(23-16-12)17-24(20,21)10-6-4-5-8(14)7(10)2/h4-6H,3H2,1-2H3,(H,15,16,17)