ethyl 5-(4-quinolin-2-ylcarbonylpiperazin-1-yl)sulfonylfuran-2-carboxylate

Systemtic Name: ethyl 5-(4-quinolin-2-ylcarbonylpiperazin-1-yl)sulfonylfuran-2-carboxylate Openeye Name: ethyl 5-[4-(quinoline-2-carbonyl)piperazin-1-yl]sulfonylfuran-2-carboxylate CAS Name: 5-[[4-[oxo(2-quinolinyl)methyl]-1-piperazinyl]sulfonyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-(quinoline-2-carbonyl)piperazin-1-yl]sulfonylfuran-2-carboxylate Traditional Name: 5-(4-quinaldoylpiperazino)sulfonylfuran-2-carboxylic acid ethyl ester Formula: C21H21N3O6S MolecularWeight: 443.47294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H21N3O6S/c1-2-29-21(26)18-9-10-19(30-18)31(27,28)24-13-11-23(12-14-24)20(25)17-8-7-15-5-3-4-6-16(15)22-17/h3-10H,2,11-14H2,1H3