N1-[[5-(4-bromophenyl)furan-2-yl]methyl]-1,2,3,4-tetrazole-1,5-diamine

Systemtic Name: N1-[[5-(4-bromophenyl)furan-2-yl]methyl]-1,2,3,4-tetrazole-1,5-diamine Openeye Name: N1-[[5-(4-bromophenyl)-2-furyl]methyl]tetrazole-1,5-diamine CAS Name: N1-[[5-(4-bromophenyl)-2-furanyl]methyl]tetrazole-1,5-diamine IUPAC Name: 1-N-[[5-(4-bromophenyl)furan-2-yl]methyl]tetrazole-1,5-diamine Traditional Name: (5-aminotetrazol-1-yl)-[[5-(4-bromophenyl)-2-furyl]methyl]amine Formula: C12H11BrN6O MolecularWeight: 335.15934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(O2)CNN3C(=NN=N3)N)Br

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(O2)CNN3C(=NN=N3)N)Br

InChI

InChI=1S/C12H11BrN6O/c13-9-3-1-8(2-4-9)11-6-5-10(20-11)7-15-19-12(14)16-17-18-19/h1-6,15H,7H2,(H2,14,16,18)