N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(tert-butylsulfamoyl)-4-chloranyl-benzamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(tert-butylsulfamoyl)-4-chloranyl-benzamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(tert-butylsulfamoyl)-4-chloro-benzamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(tert-butylsulfamoyl)-4-chlorobenzamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(tert-butylsulfamoyl)-4-chlorobenzamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(tert-butylsulfamoyl)-4-chloro-benzamide Formula: C20H22ClN3O3S2 MolecularWeight: 451.98998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=C(C=CC(=C1)C(=O)NCCC2=NC3=CC=CC=C3S2)Cl

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=C(C=CC(=C1)C(=O)NCCC2=NC3=CC=CC=C3S2)Cl

InChI

InChI=1S/C20H22ClN3O3S2/c1-20(2,3)24-29(26,27)17-12-13(8-9-14(17)21)19(25)22-11-10-18-23-15-6-4-5-7-16(15)28-18/h4-9,12,24H,10-11H2,1-3H3,(H,22,25)