2-methyl-5-(thieno[2,3-c]pyridin-6-ium-6-ylmethyl)pyrimidin-4-amine chloride hydrochloride

Systemtic Name: 2-methyl-5-(thieno[2,3-c]pyridin-6-ium-6-ylmethyl)pyrimidin-4-amine chloride hydrochloride Openeye Name: 2-methyl-5-(thieno[2,3-c]pyridin-6-ium-6-ylmethyl)pyrimidin-4-amine chloride hydrochloride CAS Name: 2-methyl-5-(6-thieno[2,3-c]pyridin-6-iumylmethyl)-4-pyrimidinamine chloride hydrochloride IUPAC Name: 2-methyl-5-(thieno[2,3-c]pyridin-6-ium-6-ylmethyl)pyrimidin-4-amine chloride hydrochloride Traditional Name: [2-methyl-5-(thieno[2,3-c]pyridin-6-ium-6-ylmethyl)pyrimidin-4-yl]amine chloride hydrochloride Formula: C13H14Cl2N4S MolecularWeight: 329.24806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=N1)N)C[N+]2=CC3=C(C=C2)C=CS3.Cl.[Cl-]

Isomeric SMILES

CC1=NC=C(C(=N1)N)C[N+]2=CC3=C(C=C2)C=CS3.Cl.[Cl-]

InChI

InChI=1S/C13H13N4S.2ClH/c1-9-15-6-11(13(14)16-9)7-17-4-2-10-3-5-18-12(10)8-17;;/h2-6,8H,7H2,1H3,(H2,14,15,16);2*1H/q+1;;/p-1