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

Systemtic Name: N-[[4-bromanyl-2-(1,2,4-triazol-1-yl)phenyl]methyl]cyclopropanamine Openeye Name: N-[[4-bromo-2-(1,2,4-triazol-1-yl)phenyl]methyl]cyclopropanamine CAS Name: N-[[4-bromo-2-(1,2,4-triazol-1-yl)phenyl]methyl]cyclopropanamine IUPAC Name: N-[[4-bromo-2-(1,2,4-triazol-1-yl)phenyl]methyl]cyclopropanamine Traditional Name: [4-bromo-2-(1,2,4-triazol-1-yl)benzyl]-cyclopropyl-amine Formula: C12H13BrN4 MolecularWeight: 293.16242

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NCC2=C(C=C(C=C2)Br)N3C=NC=N3

Isomeric SMILES

C1CC1NCC2=C(C=C(C=C2)Br)N3C=NC=N3

InChI

InChI=1S/C12H13BrN4/c13-10-2-1-9(6-15-11-3-4-11)12(5-10)17-8-14-7-16-17/h1-2,5,7-8,11,15H,3-4,6H2