methyl 4-[2-(4-phenylpiperazin-1-yl)propylsulfamoyl]benzoate

Systemtic Name: methyl 4-[2-(4-phenylpiperazin-1-yl)propylsulfamoyl]benzoate Openeye Name: methyl 4-[2-(4-phenylpiperazin-1-yl)propylsulfamoyl]benzoate CAS Name: 4-[2-(4-phenyl-1-piperazinyl)propylsulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(4-phenylpiperazin-1-yl)propylsulfamoyl]benzoate Traditional Name: 4-[2-(4-phenylpiperazino)propylsulfamoyl]benzoic acid methyl ester Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNS(=O)(=O)C1=CC=C(C=C1)C(=O)OC)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC(CNS(=O)(=O)C1=CC=C(C=C1)C(=O)OC)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O4S/c1-17(23-12-14-24(15-13-23)19-6-4-3-5-7-19)16-22-29(26,27)20-10-8-18(9-11-20)21(25)28-2/h3-11,17,22H,12-16H2,1-2H3