N-butyl-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanamide

Systemtic Name: N-butyl-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanamide Openeye Name: N-butyl-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide CAS Name: N-butyl-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide IUPAC Name: N-butyl-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide Traditional Name: N-butyl-2-(1,1,3-triketo-1,2-benzothiazol-2-yl)acetamide Formula: C13H16N2O4S MolecularWeight: 296.34214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1C(=O)C2=CC=CC=C2S1(=O)=O

Isomeric SMILES

CCCCNC(=O)CN1C(=O)C2=CC=CC=C2S1(=O)=O

InChI

InChI=1S/C13H16N2O4S/c1-2-3-8-14-12(16)9-15-13(17)10-6-4-5-7-11(10)20(15,18)19/h4-7H,2-3,8-9H2,1H3,(H,14,16)