methyl 4-[4-(4-acetamidophenyl)sulfonylpiperazin-1-yl]sulfonyl-2,5-dimethyl-furan-3-carboxylate

Systemtic Name: methyl 4-[4-(4-acetamidophenyl)sulfonylpiperazin-1-yl]sulfonyl-2,5-dimethyl-furan-3-carboxylate Openeye Name: methyl 4-[4-(4-acetamidophenyl)sulfonylpiperazin-1-yl]sulfonyl-2,5-dimethyl-furan-3-carboxylate CAS Name: 4-[[4-(4-acetamidophenyl)sulfonyl-1-piperazinyl]sulfonyl]-2,5-dimethyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 4-[4-(4-acetamidophenyl)sulfonylpiperazin-1-yl]sulfonyl-2,5-dimethylfuran-3-carboxylate Traditional Name: 4-[4-(4-acetamidophenyl)sulfonylpiperazino]sulfonyl-2,5-dimethyl-furan-3-carboxylic acid methyl ester Formula: C20H25N3O8S2 MolecularWeight: 499.5578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)C)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C)C(=O)OC

Isomeric SMILES

CC1=C(C(=C(O1)C)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C)C(=O)OC

InChI

InChI=1S/C20H25N3O8S2/c1-13-18(20(25)30-4)19(14(2)31-13)33(28,29)23-11-9-22(10-12-23)32(26,27)17-7-5-16(6-8-17)21-15(3)24/h5-8H,9-12H2,1-4H3,(H,21,24)