5-tert-butyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2,3-dimethyl-benzenesulfonamide

Systemtic Name: 5-tert-butyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2,3-dimethyl-benzenesulfonamide Openeye Name: 5-tert-butyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2,3-dimethyl-benzenesulfonamide CAS Name: 5-tert-butyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2,3-dimethylbenzenesulfonamide IUPAC Name: 5-tert-butyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2,3-dimethylbenzenesulfonamide Traditional Name: 5-tert-butyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2,3-dimethyl-benzenesulfonamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CC(=CC(=C3C)C)C(C)(C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CC(=CC(=C3C)C)C(C)(C)C

InChI

InChI=1S/C21H26N2O3S2/c1-7-26-16-8-9-17-18(12-16)27-20(22-17)23-28(24,25)19-11-15(21(4,5)6)10-13(2)14(19)3/h8-12H,7H2,1-6H3,(H,22,23)