5-[6-ethyl-2-fluoranyl-3-[(4-methyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)methyl]phenoxy]benzene-1,3-dicarbonitrile

Systemtic Name: 5-[6-ethyl-2-fluoranyl-3-[(4-methyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)methyl]phenoxy]benzene-1,3-dicarbonitrile Openeye Name: 5-[6-ethyl-2-fluoro-3-[(4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)methyl]phenoxy]benzene-1,3-dicarbonitrile CAS Name: 5-[6-ethyl-2-fluoro-3-[(4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)methyl]phenoxy]benzene-1,3-dicarbonitrile IUPAC Name: 5-[6-ethyl-2-fluoro-3-[(4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)methyl]phenoxy]benzene-1,3-dicarbonitrile Traditional Name: 5-[6-ethyl-2-fluoro-3-[(5-keto-4-methyl-1H-1,2,4-triazol-3-yl)methyl]phenoxy]isophthalonitrile Formula: C20H16FN5O2 MolecularWeight: 377.371743

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)CC2=NNC(=O)N2C)F)OC3=CC(=CC(=C3)C#N)C#N

Isomeric SMILES

CCC1=C(C(=C(C=C1)CC2=NNC(=O)N2C)F)OC3=CC(=CC(=C3)C#N)C#N

InChI

InChI=1S/C20H16FN5O2/c1-3-14-4-5-15(9-17-24-25-20(27)26(17)2)18(21)19(14)28-16-7-12(10-22)6-13(8-16)11-23/h4-8H,3,9H2,1-2H3,(H,25,27)