N-(1-oxidanylpropan-2-yl)-2-(phenylsulfonylamino)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(1-oxidanylpropan-2-yl)-2-(phenylsulfonylamino)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-(benzenesulfonamido)-N-(2-hydroxy-1-methyl-ethyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-(benzenesulfonamido)-N-(1-hydroxypropan-2-yl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-(benzenesulfonamido)-N-(1-hydroxypropan-2-yl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-(benzenesulfonamido)-N-(2-hydroxy-1-methyl-ethyl)-1,3-benzothiazole-6-carboxamide Formula: C17H17N3O4S2 MolecularWeight: 391.46458

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)NC(=O)C1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(CO)NC(=O)C1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H17N3O4S2/c1-11(10-21)18-16(22)12-7-8-14-15(9-12)25-17(19-14)20-26(23,24)13-5-3-2-4-6-13/h2-9,11,21H,10H2,1H3,(H,18,22)(H,19,20)