2-[2-ethyl-7-(4-methylpiperazin-1-yl)-3-(phenylsulfonyl)pyrazolo[1,5-a]pyrimidin-5-yl]oxyethanol

Systemtic Name: 2-[2-ethyl-7-(4-methylpiperazin-1-yl)-3-(phenylsulfonyl)pyrazolo[1,5-a]pyrimidin-5-yl]oxyethanol Openeye Name: 2-[3-(benzenesulfonyl)-2-ethyl-7-(4-methylpiperazin-1-yl)pyrazolo[1,5-a]pyrimidin-5-yl]oxyethanol CAS Name: 2-[[3-(benzenesulfonyl)-2-ethyl-7-(4-methyl-1-piperazinyl)-5-pyrazolo[1,5-a]pyrimidinyl]oxy]ethanol IUPAC Name: 2-[3-(benzenesulfonyl)-2-ethyl-7-(4-methylpiperazin-1-yl)pyrazolo[1,5-a]pyrimidin-5-yl]oxyethanol Traditional Name: 2-[3-besyl-2-ethyl-7-(4-methylpiperazino)pyrazolo[1,5-a]pyrimidin-5-yl]oxyethanol Formula: C21H27N5O4S MolecularWeight: 445.53518

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN2C(=CC(=NC2=C1S(=O)(=O)C3=CC=CC=C3)OCCO)N4CCN(CC4)C

Isomeric SMILES

CCC1=NN2C(=CC(=NC2=C1S(=O)(=O)C3=CC=CC=C3)OCCO)N4CCN(CC4)C

InChI

InChI=1S/C21H27N5O4S/c1-3-17-20(31(28,29)16-7-5-4-6-8-16)21-22-18(30-14-13-27)15-19(26(21)23-17)25-11-9-24(2)10-12-25/h4-8,15,27H,3,9-14H2,1-2H3