N-[3-oxidanylidene-3-[4-(thiophen-3-ylmethyl)piperazin-1-yl]propyl]-4-(trifluoromethyloxy)benzenesulfonamide

Systemtic Name: N-[3-oxidanylidene-3-[4-(thiophen-3-ylmethyl)piperazin-1-yl]propyl]-4-(trifluoromethyloxy)benzenesulfonamide Openeye Name: N-[3-oxo-3-[4-(3-thienylmethyl)piperazin-1-yl]propyl]-4-(trifluoromethoxy)benzenesulfonamide CAS Name: N-[3-oxo-3-[4-(3-thiophenylmethyl)-1-piperazinyl]propyl]-4-(trifluoromethoxy)benzenesulfonamide IUPAC Name: N-[3-oxo-3-[4-(thiophen-3-ylmethyl)piperazin-1-yl]propyl]-4-(trifluoromethoxy)benzenesulfonamide Traditional Name: N-[3-keto-3-[4-(3-thenyl)piperazino]propyl]-4-(trifluoromethoxy)benzenesulfonamide Formula: C19H22F3N3O4S2 MolecularWeight: 477.52089

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC=C2)C(=O)CCNS(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1CN(CCN1CC2=CSC=C2)C(=O)CCNS(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C19H22F3N3O4S2/c20-19(21,22)29-16-1-3-17(4-2-16)31(27,28)23-7-5-18(26)25-10-8-24(9-11-25)13-15-6-12-30-14-15/h1-4,6,12,14,23H,5,7-11,13H2