ethyl 5-[4-(4-acetamidophenyl)sulfonylpiperazin-1-yl]sulfonylfuran-2-carboxylate

Systemtic Name: ethyl 5-[4-(4-acetamidophenyl)sulfonylpiperazin-1-yl]sulfonylfuran-2-carboxylate Openeye Name: ethyl 5-[4-(4-acetamidophenyl)sulfonylpiperazin-1-yl]sulfonylfuran-2-carboxylate CAS Name: 5-[[4-(4-acetamidophenyl)sulfonyl-1-piperazinyl]sulfonyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-(4-acetamidophenyl)sulfonylpiperazin-1-yl]sulfonylfuran-2-carboxylate Traditional Name: 5-[4-(4-acetamidophenyl)sulfonylpiperazino]sulfonylfuran-2-carboxylic acid ethyl ester Formula: C19H23N3O8S2 MolecularWeight: 485.53122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C19H23N3O8S2/c1-3-29-19(24)17-8-9-18(30-17)32(27,28)22-12-10-21(11-13-22)31(25,26)16-6-4-15(5-7-16)20-14(2)23/h4-9H,3,10-13H2,1-2H3,(H,20,23)