N-(6-chloranyl-1,3-benzodioxol-5-yl)-2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)ethanamide

Systemtic Name: N-(6-chloranyl-1,3-benzodioxol-5-yl)-2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)ethanamide Openeye Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide CAS Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)acetamide IUPAC Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)acetamide Traditional Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide Formula: C15H12ClN5O4 MolecularWeight: 361.73988

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)NC3=CC4=C(C=C3Cl)OCO4

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)NC3=CC4=C(C=C3Cl)OCO4

InChI

InChI=1S/C15H12ClN5O4/c1-20-14-8(4-18-20)15(23)21(6-17-14)5-13(22)19-10-3-12-11(2-9(10)16)24-7-25-12/h2-4,6H,5,7H2,1H3,(H,19,22)