(4-tert-butylphenyl) 5-(1,2,3-thiadiazol-4-yl)thiophene-2-sulfonate

Systemtic Name: (4-tert-butylphenyl) 5-(1,2,3-thiadiazol-4-yl)thiophene-2-sulfonate Openeye Name: (4-tert-butylphenyl) 5-(thiadiazol-4-yl)thiophene-2-sulfonate CAS Name: 5-(4-thiadiazolyl)-2-thiophenesulfonic acid (4-tert-butylphenyl) ester IUPAC Name: (4-tert-butylphenyl) 5-(thiadiazol-4-yl)thiophene-2-sulfonate Traditional Name: 5-(thiadiazol-4-yl)thiophene-2-sulfonic acid (4-tert-butylphenyl) ester Formula: C16H16N2O3S3 MolecularWeight: 380.50484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(S2)C3=CSN=N3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(S2)C3=CSN=N3

InChI

InChI=1S/C16H16N2O3S3/c1-16(2,3)11-4-6-12(7-5-11)21-24(19,20)15-9-8-14(23-15)13-10-22-18-17-13/h4-10H,1-3H3