N-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]sulfonylethyl]-2-methylsulfanyl-benzamide

Systemtic Name: N-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]sulfonylethyl]-2-methylsulfanyl-benzamide Openeye Name: N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]sulfonylethyl]-2-methylsulfanyl-benzamide CAS Name: N-[2-[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]sulfonyl]ethyl]-2-(methylthio)benzamide IUPAC Name: N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]sulfonylethyl]-2-methylsulfanylbenzamide Traditional Name: N-[2-[4-(2-furoyl)piperazino]sulfonylethyl]-2-(methylthio)benzamide Formula: C19H23N3O5S2 MolecularWeight: 437.53302

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)NCCS(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CO3

Isomeric SMILES

CSC1=CC=CC=C1C(=O)NCCS(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CO3

InChI

InChI=1S/C19H23N3O5S2/c1-28-17-7-3-2-5-15(17)18(23)20-8-14-29(25,26)22-11-9-21(10-12-22)19(24)16-6-4-13-27-16/h2-7,13H,8-12,14H2,1H3,(H,20,23)