N-[4-[(3-chlorophenyl)amino]-2H-pyrazolo[3,4-d]pyrimidin-3-yl]benzamide

Systemtic Name: N-[4-[(3-chlorophenyl)amino]-2H-pyrazolo[3,4-d]pyrimidin-3-yl]benzamide Openeye Name: N-[4-(3-chloroanilino)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]benzamide CAS Name: N-[4-(3-chloroanilino)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]benzamide IUPAC Name: N-[4-(3-chloroanilino)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]benzamide Traditional Name: N-[4-(3-chloroanilino)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]benzamide Formula: C18H13ClN6O MolecularWeight: 364.78842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=C3C(=NN2)N=CN=C3NC4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=C3C(=NN2)N=CN=C3NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C18H13ClN6O/c19-12-7-4-8-13(9-12)22-15-14-16(21-10-20-15)24-25-17(14)23-18(26)11-5-2-1-3-6-11/h1-10H,(H3,20,21,22,23,24,25,26)