N-[[1-(2-methoxyquinolin-4-yl)carbonylpiperidin-3-yl]methyl]thiophene-2-sulfonamide

Systemtic Name: N-[[1-(2-methoxyquinolin-4-yl)carbonylpiperidin-3-yl]methyl]thiophene-2-sulfonamide Openeye Name: N-[[1-(2-methoxyquinoline-4-carbonyl)-3-piperidyl]methyl]thiophene-2-sulfonamide CAS Name: N-[[1-[(2-methoxy-4-quinolinyl)-oxomethyl]-3-piperidinyl]methyl]-2-thiophenesulfonamide IUPAC Name: N-[[1-(2-methoxyquinoline-4-carbonyl)piperidin-3-yl]methyl]thiophene-2-sulfonamide Traditional Name: N-[[1-(2-methoxyquinoline-4-carbonyl)-3-piperidyl]methyl]thiophene-2-sulfonamide Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=CC=CC=C2C(=C1)C(=O)N3CCCC(C3)CNS(=O)(=O)C4=CC=CS4

Isomeric SMILES

COC1=NC2=CC=CC=C2C(=C1)C(=O)N3CCCC(C3)CNS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H23N3O4S2/c1-28-19-12-17(16-7-2-3-8-18(16)23-19)21(25)24-10-4-6-15(14-24)13-22-30(26,27)20-9-5-11-29-20/h2-3,5,7-9,11-12,15,22H,4,6,10,13-14H2,1H3