N-(3-chloranyl-4-methoxy-phenyl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(3-chloro-4-methoxy-phenyl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(3-chloro-4-methoxyphenyl)-1-phenyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(3-chloro-4-methoxyphenyl)-1-phenylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (3-chloro-4-methoxy-phenyl)-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C18H14ClN5O MolecularWeight: 351.78966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC=NC3=C2C=NN3C4=CC=CC=C4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC=NC3=C2C=NN3C4=CC=CC=C4)Cl

InChI

InChI=1S/C18H14ClN5O/c1-25-16-8-7-12(9-15(16)19)23-17-14-10-22-24(18(14)21-11-20-17)13-5-3-2-4-6-13/h2-11H,1H3,(H,20,21,23)