[3-[(5-ethyl-1,3-thiazol-2-yl)carbamoyl]phenyl] 2,2-dimethylpropane-1-sulfonate

Systemtic Name: [3-[(5-ethyl-1,3-thiazol-2-yl)carbamoyl]phenyl] 2,2-dimethylpropane-1-sulfonate Openeye Name: [3-[(5-ethylthiazol-2-yl)carbamoyl]phenyl] 2,2-dimethylpropane-1-sulfonate CAS Name: 2,2-dimethyl-1-propanesulfonic acid IUPAC Name: [3-[(5-ethyl-1,3-thiazol-2-yl)carbamoyl]phenyl] 2,2-dimethylpropane-1-sulfonate Traditional Name: 2,2-dimethylpropane-1-sulfonic acid [3-[(5-ethylthiazol-2-yl)carbamoyl]phenyl] ester Formula: C17H22N2O4S2 MolecularWeight: 382.49758

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(S1)NC(=O)C2=CC(=CC=C2)OS(=O)(=O)CC(C)(C)C

Isomeric SMILES

CCC1=CN=C(S1)NC(=O)C2=CC(=CC=C2)OS(=O)(=O)CC(C)(C)C

InChI

InChI=1S/C17H22N2O4S2/c1-5-14-10-18-16(24-14)19-15(20)12-7-6-8-13(9-12)23-25(21,22)11-17(2,3)4/h6-10H,5,11H2,1-4H3,(H,18,19,20)