4-[4-methoxy-2-[(2-morpholin-4-ylpyridin-4-yl)carbonylamino]-1,3-benzothiazol-7-yl]piperidine-1-carboxylic acid

Systemtic Name: 4-[4-methoxy-2-[(2-morpholin-4-ylpyridin-4-yl)carbonylamino]-1,3-benzothiazol-7-yl]piperidine-1-carboxylic acid Openeye Name: 4-[4-methoxy-2-[(2-morpholinopyridine-4-carbonyl)amino]-1,3-benzothiazol-7-yl]piperidine-1-carboxylic acid CAS Name: 4-[4-methoxy-2-[[[2-(4-morpholinyl)-4-pyridinyl]-oxomethyl]amino]-1,3-benzothiazol-7-yl]-1-piperidinecarboxylic acid IUPAC Name: 4-[4-methoxy-2-[(2-morpholin-4-ylpyridine-4-carbonyl)amino]-1,3-benzothiazol-7-yl]piperidine-1-carboxylic acid Traditional Name: 4-[4-methoxy-2-[(2-morpholinoisonicotinoyl)amino]-1,3-benzothiazol-7-yl]piperidine-1-carboxylic acid Formula: C24H27N5O5S MolecularWeight: 497.56668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C3CCN(CC3)C(=O)O)SC(=N2)NC(=O)C4=CC(=NC=C4)N5CCOCC5

Isomeric SMILES

COC1=C2C(=C(C=C1)C3CCN(CC3)C(=O)O)SC(=N2)NC(=O)C4=CC(=NC=C4)N5CCOCC5

InChI

InChI=1S/C24H27N5O5S/c1-33-18-3-2-17(15-5-8-29(9-6-15)24(31)32)21-20(18)26-23(35-21)27-22(30)16-4-7-25-19(14-16)28-10-12-34-13-11-28/h2-4,7,14-15H,5-6,8-13H2,1H3,(H,31,32)(H,26,27,30)