methanesulfonic acid; 2-methoxy-N-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-5-sulfamoyl-benzamide

Systemtic Name: methanesulfonic acid; 2-methoxy-N-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-5-sulfamoyl-benzamide Openeye Name: methanesulfonic acid; 2-methoxy-N-[3-[4-(p-tolyl)piperazin-1-yl]propyl]-5-sulfamoyl-benzamide CAS Name: methanesulfonic acid; 2-methoxy-N-[3-[4-(4-methylphenyl)-1-piperazinyl]propyl]-5-sulfamoylbenzamide IUPAC Name: methanesulfonic acid; 2-methoxy-N-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-5-sulfamoylbenzamide Traditional Name: mesylic acid; 2-methoxy-N-[3-[4-(p-tolyl)piperazino]propyl]-5-sulfamoyl-benzamide Formula: C23H34N4O7S2 MolecularWeight: 542.66866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CCN(CC2)CCCNC(=O)C3=C(C=CC(=C3)S(=O)(=O)N)OC.CS(=O)(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N2CCN(CC2)CCCNC(=O)C3=C(C=CC(=C3)S(=O)(=O)N)OC.CS(=O)(=O)O

InChI

InChI=1S/C22H30N4O4S.CH4O3S/c1-17-4-6-18(7-5-17)26-14-12-25(13-15-26)11-3-10-24-22(27)20-16-19(31(23,28)29)8-9-21(20)30-2;1-5(2,3)4/h4-9,16H,3,10-15H2,1-2H3,(H,24,27)(H2,23,28,29);1H3,(H,2,3,4)