2-[4-[3-(1,4-diphenylpyrazol-3-yl)oxypropyl]piperazin-1-yl]ethanol; methanesulfonic acid

Systemtic Name: 2-[4-[3-(1,4-diphenylpyrazol-3-yl)oxypropyl]piperazin-1-yl]ethanol; methanesulfonic acid Openeye Name: 2-[4-[3-(1,4-diphenylpyrazol-3-yl)oxypropyl]piperazin-1-yl]ethanol; methanesulfonic acid CAS Name: 2-[4-[3-[(1,4-diphenyl-3-pyrazolyl)oxy]propyl]-1-piperazinyl]ethanol; methanesulfonic acid IUPAC Name: 2-[4-[3-(1,4-diphenylpyrazol-3-yl)oxypropyl]piperazin-1-yl]ethanol; methanesulfonic acid Traditional Name: 2-[4-[3-(1,4-diphenylpyrazol-3-yl)oxypropyl]piperazino]ethanol; mesylic acid Formula: C26H38N4O8S2 MolecularWeight: 598.73192

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.CS(=O)(=O)O.C1CN(CCN1CCCOC2=NN(C=C2C3=CC=CC=C3)C4=CC=CC=C4)CCO

Isomeric SMILES

CS(=O)(=O)O.CS(=O)(=O)O.C1CN(CCN1CCCOC2=NN(C=C2C3=CC=CC=C3)C4=CC=CC=C4)CCO

InChI

InChI=1S/C24H30N4O2.2CH4O3S/c29-18-17-27-15-13-26(14-16-27)12-7-19-30-24-23(21-8-3-1-4-9-21)20-28(25-24)22-10-5-2-6-11-22;2*1-5(2,3)4/h1-6,8-11,20,29H,7,12-19H2;2*1H3,(H,2,3,4)