N-(1,3-benzothiazol-2-ylmethyl)-4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazine-1-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-piperazinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazine-1-carboxamide Formula: C19H17ClF3N5OS MolecularWeight: 455.88439

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=N2)C(F)(F)F)Cl)C(=O)NCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=N2)C(F)(F)F)Cl)C(=O)NCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H17ClF3N5OS/c20-13-9-12(19(21,22)23)10-24-17(13)27-5-7-28(8-6-27)18(29)25-11-16-26-14-3-1-2-4-15(14)30-16/h1-4,9-10H,5-8,11H2,(H,25,29)