5-methyl-2-methylsulfanyl-7-[4-(phenylmethyl)piperazin-1-yl]-3-(phenylsulfonyl)pyrazolo[1,5-a]pyrimidine

Systemtic Name: 5-methyl-2-methylsulfanyl-7-[4-(phenylmethyl)piperazin-1-yl]-3-(phenylsulfonyl)pyrazolo[1,5-a]pyrimidine Openeye Name: 3-(benzenesulfonyl)-7-(4-benzylpiperazin-1-yl)-5-methyl-2-methylsulfanyl-pyrazolo[1,5-a]pyrimidine CAS Name: 3-(benzenesulfonyl)-5-methyl-2-(methylthio)-7-[4-(phenylmethyl)-1-piperazinyl]pyrazolo[1,5-a]pyrimidine IUPAC Name: 3-(benzenesulfonyl)-7-(4-benzylpiperazin-1-yl)-5-methyl-2-methylsulfanylpyrazolo[1,5-a]pyrimidine Traditional Name: 7-(4-benzylpiperazino)-3-besyl-5-methyl-2-(methylthio)pyrazolo[1,5-a]pyrimidine Formula: C25H27N5O2S2 MolecularWeight: 493.64418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C(=C1)N3CCN(CC3)CC4=CC=CC=C4)SC)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=NC2=C(C(=NN2C(=C1)N3CCN(CC3)CC4=CC=CC=C4)SC)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H27N5O2S2/c1-19-17-22(29-15-13-28(14-16-29)18-20-9-5-3-6-10-20)30-24(26-19)23(25(27-30)33-2)34(31,32)21-11-7-4-8-12-21/h3-12,17H,13-16,18H2,1-2H3