N-(5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1,3-benzothiazol-2-yl)-1-(phenylcarbonyl)piperidine-4-carboxamide

Systemtic Name: N-(5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1,3-benzothiazol-2-yl)-1-(phenylcarbonyl)piperidine-4-carboxamide Openeye Name: 1-benzoyl-N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-benzoyl-N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-benzoyl-N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-benzoyl-N-(7-keto-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-2-yl)isonipecotamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)SC(=N2)NC(=O)C3CCN(CC3)C(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)SC(=N2)NC(=O)C3CCN(CC3)C(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C22H25N3O3S/c1-22(2)12-16-18(17(26)13-22)29-21(23-16)24-19(27)14-8-10-25(11-9-14)20(28)15-6-4-3-5-7-15/h3-7,14H,8-13H2,1-2H3,(H,23,24,27)