4-(4-propylpiperazin-1-yl)-3-(thiophen-2-ylsulfonylamino)benzoic acid

Systemtic Name: 4-(4-propylpiperazin-1-yl)-3-(thiophen-2-ylsulfonylamino)benzoic acid Openeye Name: 4-(4-propylpiperazin-1-yl)-3-(2-thienylsulfonylamino)benzoic acid CAS Name: 4-(4-propyl-1-piperazinyl)-3-(thiophen-2-ylsulfonylamino)benzoic acid IUPAC Name: 4-(4-propylpiperazin-1-yl)-3-(thiophen-2-ylsulfonylamino)benzoic acid Traditional Name: 4-(4-propylpiperazino)-3-(2-thienylsulfonylamino)benzoic acid Formula: C18H23N3O4S2 MolecularWeight: 409.52292

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)O)NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)O)NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H23N3O4S2/c1-2-7-20-8-10-21(11-9-20)16-6-5-14(18(22)23)13-15(16)19-27(24,25)17-4-3-12-26-17/h3-6,12-13,19H,2,7-11H2,1H3,(H,22,23)