4-(4-chloranyl-3-ethyl-phenoxy)-1-methyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-(4-chloranyl-3-ethyl-phenoxy)-1-methyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-(4-chloro-3-ethyl-phenoxy)-1-methyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-(4-chloro-3-ethylphenoxy)-1-methylpyrazolo[3,4-d]pyrimidine IUPAC Name: 4-(4-chloro-3-ethylphenoxy)-1-methylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-(4-chloro-3-ethyl-phenoxy)-1-methyl-pyrazolo[3,4-d]pyrimidine Formula: C14H13ClN4O MolecularWeight: 288.73222

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OC2=NC=NC3=C2C=NN3C)Cl

Isomeric SMILES

CCC1=C(C=CC(=C1)OC2=NC=NC3=C2C=NN3C)Cl

InChI

InChI=1S/C14H13ClN4O/c1-3-9-6-10(4-5-12(9)15)20-14-11-7-18-19(2)13(11)16-8-17-14/h4-8H,3H2,1-2H3