3-(5-fluoranyl-2,4-dimethyl-phenyl)-2-methyl-3-oxidanyl-4-(1,2,4-triazol-1-yl)butanenitrile

Systemtic Name: 3-(5-fluoranyl-2,4-dimethyl-phenyl)-2-methyl-3-oxidanyl-4-(1,2,4-triazol-1-yl)butanenitrile Openeye Name: 3-(5-fluoro-2,4-dimethyl-phenyl)-3-hydroxy-2-methyl-4-(1,2,4-triazol-1-yl)butanenitrile CAS Name: 3-(5-fluoro-2,4-dimethylphenyl)-3-hydroxy-2-methyl-4-(1,2,4-triazol-1-yl)butanenitrile IUPAC Name: 3-(5-fluoro-2,4-dimethylphenyl)-3-hydroxy-2-methyl-4-(1,2,4-triazol-1-yl)butanenitrile Traditional Name: 3-(5-fluoro-2,4-dimethyl-phenyl)-3-hydroxy-2-methyl-4-(1,2,4-triazol-1-yl)butyronitrile Formula: C15H17FN4O MolecularWeight: 288.320083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(CN2C=NC=N2)(C(C)C#N)O)F)C

Isomeric SMILES

CC1=CC(=C(C=C1C(CN2C=NC=N2)(C(C)C#N)O)F)C

InChI

InChI=1S/C15H17FN4O/c1-10-4-11(2)14(16)5-13(10)15(21,12(3)6-17)7-20-9-18-8-19-20/h4-5,8-9,12,21H,7H2,1-3H3