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

Systemtic Name: 4-[4-methoxy-2-(morpholin-4-ylcarbonylamino)-1,3-benzothiazol-7-yl]piperidine-1-carboxylic acid Openeye Name: 4-[4-methoxy-2-(morpholine-4-carbonylamino)-1,3-benzothiazol-7-yl]piperidine-1-carboxylic acid CAS Name: 4-[4-methoxy-2-[[4-morpholinyl(oxo)methyl]amino]-1,3-benzothiazol-7-yl]-1-piperidinecarboxylic acid IUPAC Name: 4-[4-methoxy-2-(morpholine-4-carbonylamino)-1,3-benzothiazol-7-yl]piperidine-1-carboxylic acid Traditional Name: 4-[4-methoxy-2-(morpholine-4-carbonylamino)-1,3-benzothiazol-7-yl]piperidine-1-carboxylic acid Formula: C19H24N4O5S MolecularWeight: 420.48266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C3CCN(CC3)C(=O)O)SC(=N2)NC(=O)N4CCOCC4

Isomeric SMILES

COC1=C2C(=C(C=C1)C3CCN(CC3)C(=O)O)SC(=N2)NC(=O)N4CCOCC4

InChI

InChI=1S/C19H24N4O5S/c1-27-14-3-2-13(12-4-6-23(7-5-12)19(25)26)16-15(14)20-17(29-16)21-18(24)22-8-10-28-11-9-22/h2-3,12H,4-11H2,1H3,(H,25,26)(H,20,21,24)