5-[(2,7-dimethylthieno[2,3-c]pyridin-6-ium-6-yl)methyl]-2-ethyl-pyrimidin-4-amine bromide hydrobromide

Systemtic Name: 5-[(2,7-dimethylthieno[2,3-c]pyridin-6-ium-6-yl)methyl]-2-ethyl-pyrimidin-4-amine bromide hydrobromide Openeye Name: 5-[(2,7-dimethylthieno[2,3-c]pyridin-6-ium-6-yl)methyl]-2-ethyl-pyrimidin-4-amine bromide hydrobromide CAS Name: 5-[(2,7-dimethyl-6-thieno[2,3-c]pyridin-6-iumyl)methyl]-2-ethyl-4-pyrimidinamine bromide hydrobromide IUPAC Name: 5-[(2,7-dimethylthieno[2,3-c]pyridin-6-ium-6-yl)methyl]-2-ethylpyrimidin-4-amine bromide hydrobromide Traditional Name: [5-[(2,7-dimethylthieno[2,3-c]pyridin-6-ium-6-yl)methyl]-2-ethyl-pyrimidin-4-yl]amine bromide hydrobromide Formula: C16H20Br2N4S MolecularWeight: 460.2298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=C(C(=N1)N)C[N+]2=C(C3=C(C=C2)C=C(S3)C)C.Br.[Br-]

Isomeric SMILES

CCC1=NC=C(C(=N1)N)C[N+]2=C(C3=C(C=C2)C=C(S3)C)C.Br.[Br-]

InChI

InChI=1S/C16H19N4S.2BrH/c1-4-14-18-8-13(16(17)19-14)9-20-6-5-12-7-10(2)21-15(12)11(20)3;;/h5-8H,4,9H2,1-3H3,(H2,17,18,19);2*1H/q+1;;/p-1