1-[2-(5-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoyl]-N-(2-methyl-6-oxidanyl-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-(5-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoyl]-N-(2-methyl-6-oxidanyl-phenyl)piperidine-4-carboxamide Openeye Name: 1-[2-(5-chloro-2-oxo-1,3-benzothiazol-3-yl)acetyl]-N-(2-hydroxy-6-methyl-phenyl)piperidine-4-carboxamide CAS Name: 1-[2-(5-chloro-2-oxo-1,3-benzothiazol-3-yl)-1-oxoethyl]-N-(2-hydroxy-6-methylphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-(5-chloro-2-oxo-1,3-benzothiazol-3-yl)acetyl]-N-(2-hydroxy-6-methylphenyl)piperidine-4-carboxamide Traditional Name: 1-[2-(5-chloro-2-keto-1,3-benzothiazol-3-yl)acetyl]-N-(2-hydroxy-6-methyl-phenyl)isonipecotamide Formula: C22H22ClN3O4S MolecularWeight: 459.94578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)O)NC(=O)C2CCN(CC2)C(=O)CN3C4=C(C=CC(=C4)Cl)SC3=O

Isomeric SMILES

CC1=C(C(=CC=C1)O)NC(=O)C2CCN(CC2)C(=O)CN3C4=C(C=CC(=C4)Cl)SC3=O

InChI

InChI=1S/C22H22ClN3O4S/c1-13-3-2-4-17(27)20(13)24-21(29)14-7-9-25(10-8-14)19(28)12-26-16-11-15(23)5-6-18(16)31-22(26)30/h2-6,11,14,27H,7-10,12H2,1H3,(H,24,29)