6-cyclopropyl-1-(4-methoxyphenyl)-4-[4-(phenylsulfonyl)piperazin-1-yl]pyrazolo[3,4-d]pyrimidine

Systemtic Name: 6-cyclopropyl-1-(4-methoxyphenyl)-4-[4-(phenylsulfonyl)piperazin-1-yl]pyrazolo[3,4-d]pyrimidine Openeye Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-6-cyclopropyl-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidine CAS Name: 4-[4-(benzenesulfonyl)-1-piperazinyl]-6-cyclopropyl-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-6-cyclopropyl-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidine Traditional Name: 4-(4-besylpiperazino)-6-cyclopropyl-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidine Formula: C25H26N6O3S MolecularWeight: 490.57734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC(=N3)C4CC4)N5CCN(CC5)S(=O)(=O)C6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC(=N3)C4CC4)N5CCN(CC5)S(=O)(=O)C6=CC=CC=C6

InChI

InChI=1S/C25H26N6O3S/c1-34-20-11-9-19(10-12-20)31-25-22(17-26-31)24(27-23(28-25)18-7-8-18)29-13-15-30(16-14-29)35(32,33)21-5-3-2-4-6-21/h2-6,9-12,17-18H,7-8,13-16H2,1H3