6-piperidin-1-ylsulfonyl-2-thiophen-2-yl-quinoline-4-carboxylic acid

Systemtic Name: 6-piperidin-1-ylsulfonyl-2-thiophen-2-yl-quinoline-4-carboxylic acid Openeye Name: 6-(1-piperidylsulfonyl)-2-(2-thienyl)quinoline-4-carboxylic acid CAS Name: 6-(1-piperidinylsulfonyl)-2-thiophen-2-yl-4-quinolinecarboxylic acid IUPAC Name: 6-piperidin-1-ylsulfonyl-2-thiophen-2-ylquinoline-4-carboxylic acid Traditional Name: 6-piperidinosulfonyl-2-(2-thienyl)cinchoninic acid Formula: C19H18N2O4S2 MolecularWeight: 402.48722

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C(=O)O)C4=CC=CS4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C(=O)O)C4=CC=CS4

InChI

InChI=1S/C19H18N2O4S2/c22-19(23)15-12-17(18-5-4-10-26-18)20-16-7-6-13(11-14(15)16)27(24,25)21-8-2-1-3-9-21/h4-7,10-12H,1-3,8-9H2,(H,22,23)