ethyl 2-[[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]methyl]furan-3-carboxylate

Systemtic Name: ethyl 2-[[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]methyl]furan-3-carboxylate Openeye Name: ethyl 2-[[4-[(3-methyl-8-quinolyl)sulfonyl]piperazin-1-yl]methyl]furan-3-carboxylate CAS Name: 2-[[4-[(3-methyl-8-quinolinyl)sulfonyl]-1-piperazinyl]methyl]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]methyl]furan-3-carboxylate Traditional Name: 2-[[4-[(3-methyl-8-quinolyl)sulfonyl]piperazino]methyl]furan-3-carboxylic acid ethyl ester Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=CC4=CC(=CN=C43)C

Isomeric SMILES

CCOC(=O)C1=C(OC=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=CC4=CC(=CN=C43)C

InChI

InChI=1S/C22H25N3O5S/c1-3-29-22(26)18-7-12-30-19(18)15-24-8-10-25(11-9-24)31(27,28)20-6-4-5-17-13-16(2)14-23-21(17)20/h4-7,12-14H,3,8-11,15H2,1-2H3