3-chloranyl-5-[6-cyclopropyl-2-fluoranyl-3-[(4-methyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)methyl]phenoxy]benzenecarbonitrile

Systemtic Name: 3-chloranyl-5-[6-cyclopropyl-2-fluoranyl-3-[(4-methyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)methyl]phenoxy]benzenecarbonitrile Openeye Name: 3-chloro-5-[6-cyclopropyl-2-fluoro-3-[(4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)methyl]phenoxy]benzonitrile CAS Name: 3-chloro-5-[6-cyclopropyl-2-fluoro-3-[(4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)methyl]phenoxy]benzonitrile IUPAC Name: 3-chloro-5-[6-cyclopropyl-2-fluoro-3-[(4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)methyl]phenoxy]benzonitrile Traditional Name: 3-chloro-5-[6-cyclopropyl-2-fluoro-3-[(5-keto-4-methyl-1H-1,2,4-triazol-3-yl)methyl]phenoxy]benzonitrile Formula: C20H16ClFN4O2 MolecularWeight: 398.818043

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=O)CC2=C(C(=C(C=C2)C3CC3)OC4=CC(=CC(=C4)C#N)Cl)F

Isomeric SMILES

CN1C(=NNC1=O)CC2=C(C(=C(C=C2)C3CC3)OC4=CC(=CC(=C4)C#N)Cl)F

InChI

InChI=1S/C20H16ClFN4O2/c1-26-17(24-25-20(26)27)8-13-4-5-16(12-2-3-12)19(18(13)22)28-15-7-11(10-23)6-14(21)9-15/h4-7,9,12H,2-3,8H2,1H3,(H,25,27)