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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carboxamide Formula: C18H16F3N5OS MolecularWeight: 407.41275

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H16F3N5OS/c19-18(20,21)12-5-6-15(22-11-12)25-7-9-26(10-8-25)17(27)24-16-23-13-3-1-2-4-14(13)28-16/h1-6,11H,7-10H2,(H,23,24,27)