2-hydroxyethyl 3-[(E)-(3-methyl-5-sulfamoyl-1,3,4-thiadiazol-2-ylidene)amino]sulfonylbenzoate

Systemtic Name: 2-hydroxyethyl 3-[(E)-(3-methyl-5-sulfamoyl-1,3,4-thiadiazol-2-ylidene)amino]sulfonylbenzoate Openeye Name: 2-hydroxyethyl 3-[(E)-(3-methyl-5-sulfamoyl-1,3,4-thiadiazol-2-ylidene)amino]sulfonylbenzoate CAS Name: 3-[(E)-(3-methyl-5-sulfamoyl-1,3,4-thiadiazol-2-ylidene)amino]sulfonylbenzoic acid 2-hydroxyethyl ester IUPAC Name: 2-hydroxyethyl 3-[(E)-(3-methyl-5-sulfamoyl-1,3,4-thiadiazol-2-ylidene)amino]sulfonylbenzoate Traditional Name: 3-[(E)-(3-methyl-5-sulfamoyl-1,3,4-thiadiazol-2-ylidene)amino]sulfonylbenzoic acid 2-hydroxyethyl ester Formula: C12H14N4O7S3 MolecularWeight: 422.45716

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NS(=O)(=O)C2=CC=CC(=C2)C(=O)OCCO)SC(=N1)S(=O)(=O)N

Isomeric SMILES

CN1/C(=N\S(=O)(=O)C2=CC=CC(=C2)C(=O)OCCO)/SC(=N1)S(=O)(=O)N

InChI

InChI=1S/C12H14N4O7S3/c1-16-11(24-12(14-16)25(13,19)20)15-26(21,22)9-4-2-3-8(7-9)10(18)23-6-5-17/h2-4,7,17H,5-6H2,1H3,(H2,13,19,20)/b15-11+