[4-(1,2,3-thiadiazol-4-yl)phenyl] 4-tert-butylbenzenesulfonate

Systemtic Name: [4-(1,2,3-thiadiazol-4-yl)phenyl] 4-tert-butylbenzenesulfonate Openeye Name: [4-(thiadiazol-4-yl)phenyl] 4-tert-butylbenzenesulfonate CAS Name: 4-tert-butylbenzenesulfonic acid [4-(4-thiadiazolyl)phenyl] ester IUPAC Name: [4-(thiadiazol-4-yl)phenyl] 4-tert-butylbenzenesulfonate Traditional Name: 4-tert-butylbenzenesulfonic acid [4-(thiadiazol-4-yl)phenyl] ester Formula: C18H18N2O3S2 MolecularWeight: 374.47712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C3=CSN=N3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C3=CSN=N3

InChI

InChI=1S/C18H18N2O3S2/c1-18(2,3)14-6-10-16(11-7-14)25(21,22)23-15-8-4-13(5-9-15)17-12-24-20-19-17/h4-12H,1-3H3