4-[5-(5-chloranylpyridin-2-yl)-1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-6-yl]benzenecarboximidamide

Systemtic Name: 4-[5-(5-chloranylpyridin-2-yl)-1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-6-yl]benzenecarboximidamide Openeye Name: 4-[5-(5-chloro-2-pyridyl)-1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-6-yl]benzamidine CAS Name: 4-[5-(5-chloro-2-pyridinyl)-1-methyl-4-oxo-6-pyrazolo[3,4-d]pyrimidinyl]benzenecarboximidamide IUPAC Name: 4-[5-(5-chloropyridin-2-yl)-1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-6-yl]benzenecarboximidamide Traditional Name: 4-[5-(5-chloro-2-pyridyl)-4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]benzamidine Formula: C18H14ClN7O MolecularWeight: 379.80306

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C(=N2)C3=CC=C(C=C3)C(=N)N)C4=NC=C(C=C4)Cl

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C(=N2)C3=CC=C(C=C3)C(=N)N)C4=NC=C(C=C4)Cl

InChI

InChI=1S/C18H14ClN7O/c1-25-17-13(9-23-25)18(27)26(14-7-6-12(19)8-22-14)16(24-17)11-4-2-10(3-5-11)15(20)21/h2-9H,1H3,(H3,20,21)