ethyl 5-[4-(3-cyanophenyl)sulfonylpiperazin-1-yl]sulfonylfuran-2-carboxylate

Systemtic Name: ethyl 5-[4-(3-cyanophenyl)sulfonylpiperazin-1-yl]sulfonylfuran-2-carboxylate Openeye Name: ethyl 5-[4-(3-cyanophenyl)sulfonylpiperazin-1-yl]sulfonylfuran-2-carboxylate CAS Name: 5-[[4-(3-cyanophenyl)sulfonyl-1-piperazinyl]sulfonyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-(3-cyanophenyl)sulfonylpiperazin-1-yl]sulfonylfuran-2-carboxylate Traditional Name: 5-[4-(3-cyanophenyl)sulfonylpiperazino]sulfonylfuran-2-carboxylic acid ethyl ester Formula: C18H19N3O7S2 MolecularWeight: 453.48936

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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=CC(=C3)C#N

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O7S2/c1-2-27-18(22)16-6-7-17(28-16)30(25,26)21-10-8-20(9-11-21)29(23,24)15-5-3-4-14(12-15)13-19/h3-7,12H,2,8-11H2,1H3