1-phenyl-4-[4-[phenyl(thiophen-2-yl)methyl]piperazin-1-yl]pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-phenyl-4-[4-[phenyl(thiophen-2-yl)methyl]piperazin-1-yl]pyrazolo[3,4-d]pyrimidine Openeye Name: 1-phenyl-4-[4-[phenyl(2-thienyl)methyl]piperazin-1-yl]pyrazolo[3,4-d]pyrimidine CAS Name: 1-phenyl-4-[4-[phenyl(thiophen-2-yl)methyl]-1-piperazinyl]pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-phenyl-4-[4-[phenyl(thiophen-2-yl)methyl]piperazin-1-yl]pyrazolo[3,4-d]pyrimidine Traditional Name: 1-phenyl-4-[4-[phenyl(2-thienyl)methyl]piperazino]pyrazolo[3,4-d]pyrimidine Formula: C26H24N6S MolecularWeight: 452.57396

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=C2C=NN3C4=CC=CC=C4)C(C5=CC=CC=C5)C6=CC=CS6

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=C2C=NN3C4=CC=CC=C4)C(C5=CC=CC=C5)C6=CC=CS6

InChI

InChI=1S/C26H24N6S/c1-3-8-20(9-4-1)24(23-12-7-17-33-23)30-13-15-31(16-14-30)25-22-18-29-32(26(22)28-19-27-25)21-10-5-2-6-11-21/h1-12,17-19,24H,13-16H2