4-[4-(3-chlorophenyl)piperazin-1-yl]-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidine Openeye Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidine CAS Name: 4-[4-(3-chlorophenyl)-1-piperazinyl]-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidine Traditional Name: 4-[4-(3-chlorophenyl)piperazino]-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidine Formula: C22H21ClN6O MolecularWeight: 420.89474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)N4CCN(CC4)C5=CC(=CC=C5)Cl

Isomeric SMILES

COC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)N4CCN(CC4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C22H21ClN6O/c1-30-19-7-5-17(6-8-19)29-22-20(14-26-29)21(24-15-25-22)28-11-9-27(10-12-28)18-4-2-3-16(23)13-18/h2-8,13-15H,9-12H2,1H3