5-cyclopropyl-7-(4-methylpiperazin-1-yl)-2-methylsulfanyl-3-(phenylsulfonyl)pyrazolo[1,5-a]pyrimidine

Systemtic Name: 5-cyclopropyl-7-(4-methylpiperazin-1-yl)-2-methylsulfanyl-3-(phenylsulfonyl)pyrazolo[1,5-a]pyrimidine Openeye Name: 3-(benzenesulfonyl)-5-cyclopropyl-7-(4-methylpiperazin-1-yl)-2-methylsulfanyl-pyrazolo[1,5-a]pyrimidine CAS Name: 3-(benzenesulfonyl)-5-cyclopropyl-7-(4-methyl-1-piperazinyl)-2-(methylthio)pyrazolo[1,5-a]pyrimidine IUPAC Name: 3-(benzenesulfonyl)-5-cyclopropyl-7-(4-methylpiperazin-1-yl)-2-methylsulfanylpyrazolo[1,5-a]pyrimidine Traditional Name: 3-besyl-5-cyclopropyl-7-(4-methylpiperazino)-2-(methylthio)pyrazolo[1,5-a]pyrimidine Formula: C21H25N5O2S2 MolecularWeight: 443.5855

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=NC3=C(C(=NN23)SC)S(=O)(=O)C4=CC=CC=C4)C5CC5

Isomeric SMILES

CN1CCN(CC1)C2=CC(=NC3=C(C(=NN23)SC)S(=O)(=O)C4=CC=CC=C4)C5CC5

InChI

InChI=1S/C21H25N5O2S2/c1-24-10-12-25(13-11-24)18-14-17(15-8-9-15)22-20-19(21(29-2)23-26(18)20)30(27,28)16-6-4-3-5-7-16/h3-7,14-15H,8-13H2,1-2H3