2-dimethylaminoethyl 3-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)sulfamoyl]benzoate

Systemtic Name: 2-dimethylaminoethyl 3-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)sulfamoyl]benzoate Openeye Name: 2-dimethylaminoethyl 3-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)sulfamoyl]benzoate CAS Name: 3-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)sulfamoyl]benzoic acid 2-dimethylaminoethyl ester IUPAC Name: 2-dimethylaminoethyl 3-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)sulfamoyl]benzoate Traditional Name: 3-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)sulfamoyl]benzoic acid 2-dimethylaminoethyl ester Formula: C13H17N5O6S3 MolecularWeight: 435.49898

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=NN=C(S2)S(=O)(=O)N

Isomeric SMILES

CN(C)CCOC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=NN=C(S2)S(=O)(=O)N

InChI

InChI=1S/C13H17N5O6S3/c1-18(2)6-7-24-11(19)9-4-3-5-10(8-9)27(22,23)17-12-15-16-13(25-12)26(14,20)21/h3-5,8H,6-7H2,1-2H3,(H,15,17)(H2,14,20,21)