N-(2-methyl-5-phenyl-pyrazol-3-yl)-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanamide

Systemtic Name: N-(2-methyl-5-phenyl-pyrazol-3-yl)-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanamide Openeye Name: N-(2-methyl-5-phenyl-pyrazol-3-yl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide CAS Name: N-(2-methyl-5-phenyl-3-pyrazolyl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide IUPAC Name: N-(2-methyl-5-phenylpyrazol-3-yl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide Traditional Name: N-(2-methyl-5-phenyl-pyrazol-3-yl)-2-(1,1,3-triketo-1,2-benzothiazol-2-yl)acetamide Formula: C19H16N4O4S MolecularWeight: 396.41974

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C2=CC=CC=C2)NC(=O)CN3C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

CN1C(=CC(=N1)C2=CC=CC=C2)NC(=O)CN3C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C19H16N4O4S/c1-22-17(11-15(21-22)13-7-3-2-4-8-13)20-18(24)12-23-19(25)14-9-5-6-10-16(14)28(23,26)27/h2-11H,12H2,1H3,(H,20,24)