N-[4-fluoranyl-3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-2-methoxy-ethanamide

Systemtic Name: N-[4-fluoranyl-3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-2-methoxy-ethanamide Openeye Name: N-[4-fluoro-3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-2-methoxy-acetamide CAS Name: N-[4-fluoro-3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-2-methoxyacetamide IUPAC Name: N-[4-fluoro-3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-2-methoxyacetamide Traditional Name: N-[4-fluoro-3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazol[4,3-a]azepin-3-yl)phenyl]-2-methoxy-acetamide Formula: C16H19FN4O2 MolecularWeight: 318.346063

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)NC1=CC(=C(C=C1)F)C2=NN=C3N2CCCCC3

Isomeric SMILES

COCC(=O)NC1=CC(=C(C=C1)F)C2=NN=C3N2CCCCC3

InChI

InChI=1S/C16H19FN4O2/c1-23-10-15(22)18-11-6-7-13(17)12(9-11)16-20-19-14-5-3-2-4-8-21(14)16/h6-7,9H,2-5,8,10H2,1H3,(H,18,22)