1-(5-chloranyl-2-methyl-phenyl)-4-(3,4-dimethylphenoxy)pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-(5-chloranyl-2-methyl-phenyl)-4-(3,4-dimethylphenoxy)pyrazolo[3,4-d]pyrimidine Openeye Name: 1-(5-chloro-2-methyl-phenyl)-4-(3,4-dimethylphenoxy)pyrazolo[3,4-d]pyrimidine CAS Name: 1-(5-chloro-2-methylphenyl)-4-(3,4-dimethylphenoxy)pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-(5-chloro-2-methylphenyl)-4-(3,4-dimethylphenoxy)pyrazolo[3,4-d]pyrimidine Traditional Name: 1-(5-chloro-2-methyl-phenyl)-4-(3,4-dimethylphenoxy)pyrazolo[3,4-d]pyrimidine Formula: C20H17ClN4O MolecularWeight: 364.82818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC2=NC=NC3=C2C=NN3C4=C(C=CC(=C4)Cl)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC2=NC=NC3=C2C=NN3C4=C(C=CC(=C4)Cl)C)C

InChI

InChI=1S/C20H17ClN4O/c1-12-5-7-16(8-14(12)3)26-20-17-10-24-25(19(17)22-11-23-20)18-9-15(21)6-4-13(18)2/h4-11H,1-3H3