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

Systemtic Name: N-(4-bromanyl-2-chloranyl-phenyl)-2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)ethanamide Openeye Name: N-(4-bromo-2-chloro-phenyl)-2-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide CAS Name: N-(4-bromo-2-chlorophenyl)-2-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)acetamide IUPAC Name: N-(4-bromo-2-chlorophenyl)-2-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)acetamide Traditional Name: N-(4-bromo-2-chloro-phenyl)-2-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide Formula: C14H11BrClN5O2 MolecularWeight: 396.62644

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)NC3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)NC3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C14H11BrClN5O2/c1-20-13-9(5-18-20)14(23)21(7-17-13)6-12(22)19-11-3-2-8(15)4-10(11)16/h2-5,7H,6H2,1H3,(H,19,22)