N-(2,1,3-benzothiadiazol-4-yl)-2-(4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)ethanamide

Systemtic Name: N-(2,1,3-benzothiadiazol-4-yl)-2-(4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)ethanamide Openeye Name: N-(2,1,3-benzothiadiazol-4-yl)-2-(4-oxo-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide CAS Name: N-(2,1,3-benzothiadiazol-4-yl)-2-(4-oxo-1-phenyl-5-pyrazolo[3,4-d]pyrimidinyl)acetamide IUPAC Name: N-(2,1,3-benzothiadiazol-4-yl)-2-(4-oxo-1-phenylpyrazolo[3,4-d]pyrimidin-5-yl)acetamide Traditional Name: 2-(4-keto-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)-N-piazthiol-4-yl-acetamide Formula: C19H13N7O2S MolecularWeight: 403.41722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=O)N(C=N3)CC(=O)NC4=CC=CC5=NSN=C54

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=O)N(C=N3)CC(=O)NC4=CC=CC5=NSN=C54

InChI

InChI=1S/C19H13N7O2S/c27-16(22-14-7-4-8-15-17(14)24-29-23-15)10-25-11-20-18-13(19(25)28)9-21-26(18)12-5-2-1-3-6-12/h1-9,11H,10H2,(H,22,27)