1-[3-(1,4-diphenylpyrazol-3-yl)oxypropyl]-4-methyl-piperazine; methanesulfonic acid

Systemtic Name: 1-[3-(1,4-diphenylpyrazol-3-yl)oxypropyl]-4-methyl-piperazine; methanesulfonic acid Openeye Name: 1-[3-(1,4-diphenylpyrazol-3-yl)oxypropyl]-4-methyl-piperazine; methanesulfonic acid CAS Name: 1-[3-[(1,4-diphenyl-3-pyrazolyl)oxy]propyl]-4-methylpiperazine; methanesulfonic acid IUPAC Name: 1-[3-(1,4-diphenylpyrazol-3-yl)oxypropyl]-4-methylpiperazine; methanesulfonic acid Traditional Name: 1-[3-(1,4-diphenylpyrazol-3-yl)oxypropyl]-4-methyl-piperazine; mesylic acid Formula: C25H36N4O7S2 MolecularWeight: 568.70594

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCOC2=NN(C=C2C3=CC=CC=C3)C4=CC=CC=C4.CS(=O)(=O)O.CS(=O)(=O)O

Isomeric SMILES

CN1CCN(CC1)CCCOC2=NN(C=C2C3=CC=CC=C3)C4=CC=CC=C4.CS(=O)(=O)O.CS(=O)(=O)O

InChI

InChI=1S/C23H28N4O.2CH4O3S/c1-25-14-16-26(17-15-25)13-8-18-28-23-22(20-9-4-2-5-10-20)19-27(24-23)21-11-6-3-7-12-21;2*1-5(2,3)4/h2-7,9-12,19H,8,13-18H2,1H3;2*1H3,(H,2,3,4)