N-(4-tert-butyl-1,3-thiazol-2-yl)-3-(phenylsulfonylmethyl)benzamide

Systemtic Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-3-(phenylsulfonylmethyl)benzamide Openeye Name: 3-(benzenesulfonylmethyl)-N-(4-tert-butylthiazol-2-yl)benzamide CAS Name: 3-(benzenesulfonylmethyl)-N-(4-tert-butyl-2-thiazolyl)benzamide IUPAC Name: 3-(benzenesulfonylmethyl)-N-(4-tert-butyl-1,3-thiazol-2-yl)benzamide Traditional Name: 3-(besylmethyl)-N-(4-tert-butylthiazol-2-yl)benzamide Formula: C21H22N2O3S2 MolecularWeight: 414.54098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)NC(=O)C2=CC(=CC=C2)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)NC(=O)C2=CC(=CC=C2)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O3S2/c1-21(2,3)18-13-27-20(22-18)23-19(24)16-9-7-8-15(12-16)14-28(25,26)17-10-5-4-6-11-17/h4-13H,14H2,1-3H3,(H,22,23,24)