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

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-4-(4-propan-2-ylphenoxy)pyrazolo[3,4-d]pyrimidine Openeye Name: 1-(3-chloro-4-methyl-phenyl)-4-(4-isopropylphenoxy)pyrazolo[3,4-d]pyrimidine CAS Name: 1-(3-chloro-4-methylphenyl)-4-(4-propan-2-ylphenoxy)pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-(3-chloro-4-methylphenyl)-4-(4-propan-2-ylphenoxy)pyrazolo[3,4-d]pyrimidine Traditional Name: 1-(3-chloro-4-methyl-phenyl)-4-(4-isopropylphenoxy)pyrazolo[3,4-d]pyrimidine Formula: C21H19ClN4O MolecularWeight: 378.85476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NC=N3)OC4=CC=C(C=C4)C(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NC=N3)OC4=CC=C(C=C4)C(C)C)Cl

InChI

InChI=1S/C21H19ClN4O/c1-13(2)15-5-8-17(9-6-15)27-21-18-11-25-26(20(18)23-12-24-21)16-7-4-14(3)19(22)10-16/h4-13H,1-3H3