6-[[5-(4-bromophenyl)-1H-imidazol-2-yl]sulfanylmethyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[[5-(4-bromophenyl)-1H-imidazol-2-yl]sulfanylmethyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[[5-(4-bromophenyl)-1H-imidazol-2-yl]sulfanylmethyl]-1,3,5-triazine-2,4-diamine CAS Name: 6-[[[5-(4-bromophenyl)-1H-imidazol-2-yl]thio]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[[5-(4-bromophenyl)-1H-imidazol-2-yl]sulfanylmethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[[5-(4-bromophenyl)-1H-imidazol-2-yl]thio]methyl]-s-triazin-2-yl]amine Formula: C13H12BrN7S MolecularWeight: 378.25028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CN=C(N2)SCC3=NC(=NC(=N3)N)N)Br

Isomeric SMILES

C1=CC(=CC=C1C2=CN=C(N2)SCC3=NC(=NC(=N3)N)N)Br

InChI

InChI=1S/C13H12BrN7S/c14-8-3-1-7(2-4-8)9-5-17-13(18-9)22-6-10-19-11(15)21-12(16)20-10/h1-5H,6H2,(H,17,18)(H4,15,16,19,20,21)