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

Systemtic Name: N-[[3-fluoranyl-4-(1,2,4-triazol-1-yl)phenyl]methyl]cyclopropanamine Openeye Name: N-[[3-fluoro-4-(1,2,4-triazol-1-yl)phenyl]methyl]cyclopropanamine CAS Name: N-[[3-fluoro-4-(1,2,4-triazol-1-yl)phenyl]methyl]cyclopropanamine IUPAC Name: N-[[3-fluoro-4-(1,2,4-triazol-1-yl)phenyl]methyl]cyclopropanamine Traditional Name: cyclopropyl-[3-fluoro-4-(1,2,4-triazol-1-yl)benzyl]amine Formula: C12H13FN4 MolecularWeight: 232.256823

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NCC2=CC(=C(C=C2)N3C=NC=N3)F

Isomeric SMILES

C1CC1NCC2=CC(=C(C=C2)N3C=NC=N3)F

InChI

InChI=1S/C12H13FN4/c13-11-5-9(6-15-10-2-3-10)1-4-12(11)17-8-14-7-16-17/h1,4-5,7-8,10,15H,2-3,6H2