N-(1,3-benzothiazol-2-yl)-N-[2-chloranyl-5-(trifluoromethyl)phenyl]-1-ethanoyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-[2-chloranyl-5-(trifluoromethyl)phenyl]-1-ethanoyl-piperidine-4-carboxamide Openeye Name: 1-acetyl-N-(1,3-benzothiazol-2-yl)-N-[2-chloro-5-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: 1-acetyl-N-(1,3-benzothiazol-2-yl)-N-[2-chloro-5-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-acetyl-N-(1,3-benzothiazol-2-yl)-N-[2-chloro-5-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-acetyl-N-(1,3-benzothiazol-2-yl)-N-[2-chloro-5-(trifluoromethyl)phenyl]isonipecotamide Formula: C22H19ClF3N3O2S MolecularWeight: 481.91837

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)C(=O)N(C2=C(C=CC(=C2)C(F)(F)F)Cl)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(=O)N1CCC(CC1)C(=O)N(C2=C(C=CC(=C2)C(F)(F)F)Cl)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H19ClF3N3O2S/c1-13(30)28-10-8-14(9-11-28)20(31)29(21-27-17-4-2-3-5-19(17)32-21)18-12-15(22(24,25)26)6-7-16(18)23/h2-7,12,14H,8-11H2,1H3