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

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl-[(5-bromanylthiophen-2-yl)methyl]-methyl-azanium Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl-[(5-bromo-2-thienyl)methyl]-methyl-ammonium CAS Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl-[(5-bromo-2-thiophenyl)methyl]-methylammonium IUPAC Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl-[(5-bromothiophen-2-yl)methyl]-methylazanium Traditional Name: (4-amino-6-anilino-s-triazin-2-yl)methyl-[(5-bromo-2-thienyl)methyl]-methyl-ammonium Formula: C16H18BrN6S+ MolecularWeight: 406.32332

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(S1)Br)CC2=NC(=NC(=N2)NC3=CC=CC=C3)N

Isomeric SMILES

C[NH+](CC1=CC=C(S1)Br)CC2=NC(=NC(=N2)NC3=CC=CC=C3)N

InChI

InChI=1S/C16H17BrN6S/c1-23(9-12-7-8-13(17)24-12)10-14-20-15(18)22-16(21-14)19-11-5-3-2-4-6-11/h2-8H,9-10H2,1H3,(H3,18,19,20,21,22)/p+1