4-[[6-(3-chlorophenyl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]amino]benzamide

Systemtic Name: 4-[[6-(3-chlorophenyl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]amino]benzamide Openeye Name: 4-[[6-(3-chlorophenyl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]amino]benzamide CAS Name: 4-[[6-(3-chlorophenyl)-1-methyl-4-pyrazolo[3,4-d]pyrimidinyl]amino]benzamide IUPAC Name: 4-[[6-(3-chlorophenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]benzamide Traditional Name: 4-[[6-(3-chlorophenyl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]amino]benzamide Formula: C19H15ClN6O MolecularWeight: 378.815

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)C3=CC(=CC=C3)Cl)NC4=CC=C(C=C4)C(=O)N

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)C3=CC(=CC=C3)Cl)NC4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C19H15ClN6O/c1-26-19-15(10-22-26)18(23-14-7-5-11(6-8-14)16(21)27)24-17(25-19)12-3-2-4-13(20)9-12/h2-10H,1H3,(H2,21,27)(H,23,24,25)