2-[1,3-benzothiazol-2-yl(phenylsulfonyl)amino]-N-butyl-ethanamide

Systemtic Name: 2-[1,3-benzothiazol-2-yl(phenylsulfonyl)amino]-N-butyl-ethanamide Openeye Name: 2-[benzenesulfonyl(1,3-benzothiazol-2-yl)amino]-N-butyl-acetamide CAS Name: 2-[benzenesulfonyl(1,3-benzothiazol-2-yl)amino]-N-butylacetamide IUPAC Name: 2-[benzenesulfonyl(1,3-benzothiazol-2-yl)amino]-N-butylacetamide Traditional Name: 2-[1,3-benzothiazol-2-yl(besyl)amino]-N-butyl-acetamide Formula: C19H21N3O3S2 MolecularWeight: 403.51834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN(C1=NC2=CC=CC=C2S1)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)CN(C1=NC2=CC=CC=C2S1)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H21N3O3S2/c1-2-3-13-20-18(23)14-22(27(24,25)15-9-5-4-6-10-15)19-21-16-11-7-8-12-17(16)26-19/h4-12H,2-3,13-14H2,1H3,(H,20,23)