3-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonyl-4-methoxy-benzenesulfonamide

Systemtic Name: 3-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonyl-4-methoxy-benzenesulfonamide Openeye Name: 3-[(3R)-3-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-4-methoxy-benzenesulfonamide CAS Name: 3-[[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-oxomethyl]-4-methoxybenzenesulfonamide IUPAC Name: 3-[(3R)-3-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-4-methoxybenzenesulfonamide Traditional Name: 3-[(3R)-3-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-4-methoxy-benzenesulfonamide Formula: C20H21N3O4S2 MolecularWeight: 431.52844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)N2CCC[C@H](C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H21N3O4S2/c1-27-17-9-8-14(29(21,25)26)11-15(17)20(24)23-10-4-5-13(12-23)19-22-16-6-2-3-7-18(16)28-19/h2-3,6-9,11,13H,4-5,10,12H2,1H3,(H2,21,25,26)/t13-/m1/s1