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

Systemtic Name: 1-(3-chlorophenyl)-N-(5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-(3-chlorophenyl)-N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-(3-chlorophenyl)-N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-(3-chlorophenyl)-N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-(3-chlorophenyl)-N-(7-keto-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-2-yl)isonipecotamide Formula: C21H24ClN3O2S MolecularWeight: 417.95216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24ClN3O2S/c1-21(2)11-16-18(17(26)12-21)28-20(23-16)24-19(27)13-6-8-25(9-7-13)15-5-3-4-14(22)10-15/h3-5,10,13H,6-9,11-12H2,1-2H3,(H,23,24,27)