1-[(2-bromophenyl)sulfanylmethyl]pyrimidin-1-ium-2-amine

Systemtic Name: 1-[(2-bromophenyl)sulfanylmethyl]pyrimidin-1-ium-2-amine Openeye Name: 1-[(2-bromophenyl)sulfanylmethyl]pyrimidin-1-ium-2-amine CAS Name: 1-[[(2-bromophenyl)thio]methyl]-2-pyrimidin-1-iumamine IUPAC Name: 1-[(2-bromophenyl)sulfanylmethyl]pyrimidin-1-ium-2-amine Traditional Name: [1-[[(2-bromophenyl)thio]methyl]pyrimidin-1-ium-2-yl]amine Formula: C11H11BrN3S+ MolecularWeight: 297.19414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)SC[N+]2=CC=CN=C2N)Br

Isomeric SMILES

C1=CC=C(C(=C1)SC[N+]2=CC=CN=C2N)Br

InChI

InChI=1S/C11H10BrN3S/c12-9-4-1-2-5-10(9)16-8-15-7-3-6-14-11(15)13/h1-7,13H,8H2/p+1