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

Systemtic Name: N-(2-cyclopentylpyrazol-3-yl)-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanamide Openeye Name: N-(2-cyclopentylpyrazol-3-yl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide CAS Name: N-(2-cyclopentyl-3-pyrazolyl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide IUPAC Name: N-(2-cyclopentylpyrazol-3-yl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide Traditional Name: N-(2-cyclopentylpyrazol-3-yl)-2-(1,1,3-triketo-1,2-benzothiazol-2-yl)acetamide Formula: C17H18N4O4S MolecularWeight: 374.41422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=CC=N2)NC(=O)CN3C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

C1CCC(C1)N2C(=CC=N2)NC(=O)CN3C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C17H18N4O4S/c22-16(19-15-9-10-18-21(15)12-5-1-2-6-12)11-20-17(23)13-7-3-4-8-14(13)26(20,24)25/h3-4,7-10,12H,1-2,5-6,11H2,(H,19,22)