N-[[3-fluoranyl-4-(1,2,4-triazol-1-yl)phenyl]methyl]ethanamine

Systemtic Name: N-[[3-fluoranyl-4-(1,2,4-triazol-1-yl)phenyl]methyl]ethanamine Openeye Name: N-[[3-fluoro-4-(1,2,4-triazol-1-yl)phenyl]methyl]ethanamine CAS Name: N-[[3-fluoro-4-(1,2,4-triazol-1-yl)phenyl]methyl]ethanamine IUPAC Name: N-[[3-fluoro-4-(1,2,4-triazol-1-yl)phenyl]methyl]ethanamine Traditional Name: ethyl-[3-fluoro-4-(1,2,4-triazol-1-yl)benzyl]amine Formula: C11H13FN4 MolecularWeight: 220.246123

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=CC(=C(C=C1)N2C=NC=N2)F

Isomeric SMILES

CCNCC1=CC(=C(C=C1)N2C=NC=N2)F

InChI

InChI=1S/C11H13FN4/c1-2-13-6-9-3-4-11(10(12)5-9)16-8-14-7-15-16/h3-5,7-8,13H,2,6H2,1H3