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

Systemtic Name: 2-ethylsulfanyl-N-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]sulfonylethyl]benzamide Openeye Name: 2-ethylsulfanyl-N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]sulfonylethyl]benzamide CAS Name: 2-(ethylthio)-N-[2-[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]sulfonyl]ethyl]benzamide IUPAC Name: 2-ethylsulfanyl-N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]sulfonylethyl]benzamide Traditional Name: 2-(ethylthio)-N-[2-[4-(2-furoyl)piperazino]sulfonylethyl]benzamide Formula: C20H25N3O5S2 MolecularWeight: 451.5596

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)NCCS(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CO3

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)NCCS(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CO3

InChI

InChI=1S/C20H25N3O5S2/c1-2-29-18-8-4-3-6-16(18)19(24)21-9-15-30(26,27)23-12-10-22(11-13-23)20(25)17-7-5-14-28-17/h3-8,14H,2,9-13,15H2,1H3,(H,21,24)