[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl-[(5-bromanylthiophen-2-yl)methyl]-methyl-azanium

Systemtic Name: [4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl-[(5-bromanylthiophen-2-yl)methyl]-methyl-azanium Openeye Name: [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl-[(5-bromo-2-thienyl)methyl]-methyl-ammonium CAS Name: [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl-[(5-bromo-2-thiophenyl)methyl]-methylammonium IUPAC Name: [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl-[(5-bromothiophen-2-yl)methyl]-methylazanium Traditional Name: [4-amino-6-(dimethylamino)-s-triazin-2-yl]methyl-[(5-bromo-2-thienyl)methyl]-methyl-ammonium Formula: C12H18BrN6S+ MolecularWeight: 358.28052

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(S1)Br)CC2=NC(=NC(=N2)N(C)C)N

Isomeric SMILES

C[NH+](CC1=CC=C(S1)Br)CC2=NC(=NC(=N2)N(C)C)N

InChI

InChI=1S/C12H17BrN6S/c1-18(2)12-16-10(15-11(14)17-12)7-19(3)6-8-4-5-9(13)20-8/h4-5H,6-7H2,1-3H3,(H2,14,15,16,17)/p+1