3-[1-[4-(4-chlorophenyl)sulfonylphenyl]pyrazol-3-yl]oxy-N,N-dimethyl-propan-1-amine; methanesulfonate

Systemtic Name: 3-[1-[4-(4-chlorophenyl)sulfonylphenyl]pyrazol-3-yl]oxy-N,N-dimethyl-propan-1-amine; methanesulfonate Openeye Name: 3-[1-[4-(4-chlorophenyl)sulfonylphenyl]pyrazol-3-yl]oxy-N,N-dimethyl-propan-1-amine; methanesulfonate CAS Name: 3-[[1-[4-(4-chlorophenyl)sulfonylphenyl]-3-pyrazolyl]oxy]-N,N-dimethyl-1-propanamine; methanesulfonate IUPAC Name: 3-[1-[4-(4-chlorophenyl)sulfonylphenyl]pyrazol-3-yl]oxy-N,N-dimethylpropan-1-amine; methanesulfonate Traditional Name: 3-[1-[4-(4-chlorophenyl)sulfonylphenyl]pyrazol-3-yl]oxypropyl-dimethyl-amine mesylate Formula: C21H25ClN3O6S2- MolecularWeight: 515.0227

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC1=NN(C=C1)C2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)Cl.CS(=O)(=O)[O-]

Isomeric SMILES

CN(C)CCCOC1=NN(C=C1)C2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)Cl.CS(=O)(=O)[O-]

InChI

InChI=1S/C20H22ClN3O3S.CH4O3S/c1-23(2)13-3-15-27-20-12-14-24(22-20)17-6-10-19(11-7-17)28(25,26)18-8-4-16(21)5-9-18;1-5(2,3)4/h4-12,14H,3,13,15H2,1-2H3;1H3,(H,2,3,4)/p-1