5-methyl-3-(pyridin-1-ium-1-ylmethyl)-1,3,4-thiadiazol-3-ium-2-amine dichloride

Systemtic Name: 5-methyl-3-(pyridin-1-ium-1-ylmethyl)-1,3,4-thiadiazol-3-ium-2-amine dichloride Openeye Name: 5-methyl-3-(pyridin-1-ium-1-ylmethyl)-1,3,4-thiadiazol-3-ium-2-amine dichloride CAS Name: 5-methyl-3-(1-pyridin-1-iumylmethyl)-1,3,4-thiadiazol-3-ium-2-amine dichloride IUPAC Name: 5-methyl-3-(pyridin-1-ium-1-ylmethyl)-1,3,4-thiadiazol-3-ium-2-amine dichloride Traditional Name: [5-methyl-3-(pyridin-1-ium-1-ylmethyl)-1,3,4-thiadiazol-3-ium-2-yl]amine dichloride Formula: C9H12Cl2N4S MolecularWeight: 279.18938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=N[N+](=C(S1)N)C[N+]2=CC=CC=C2.[Cl-].[Cl-]

Isomeric SMILES

CC1=N[N+](=C(S1)N)C[N+]2=CC=CC=C2.[Cl-].[Cl-]

InChI

InChI=1S/C9H11N4S.2ClH/c1-8-11-13(9(10)14-8)7-12-5-3-2-4-6-12;;/h2-6,10H,7H2,1H3;2*1H/q+1;;/p-1