4-fluoranyl-N-[2-[[5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 4-fluoranyl-N-[2-[[5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1-benzothiophene-2-carboxamide Openeye Name: 4-fluoro-N-[2-[[5-(trifluoromethyl)-2-pyridyl]amino]ethyl]benzothiophene-2-carboxamide CAS Name: 4-fluoro-N-[2-[[5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 4-fluoro-N-[2-[[5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1-benzothiophene-2-carboxamide Traditional Name: 4-fluoro-N-[2-[[5-(trifluoromethyl)-2-pyridyl]amino]ethyl]benzothiophene-2-carboxamide Formula: C17H13F4N3OS MolecularWeight: 383.363233

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=C(SC2=C1)C(=O)NCCNC3=NC=C(C=C3)C(F)(F)F)F

Isomeric SMILES

C1=CC(=C2C=C(SC2=C1)C(=O)NCCNC3=NC=C(C=C3)C(F)(F)F)F

InChI

InChI=1S/C17H13F4N3OS/c18-12-2-1-3-13-11(12)8-14(26-13)16(25)23-7-6-22-15-5-4-10(9-24-15)17(19,20)21/h1-5,8-9H,6-7H2,(H,22,24)(H,23,25)