3-[5-(2,4,6-trimethylpyridin-1-ium-1-yl)-1,3,4-thiadiazol-2-yl]propan-1-amine

Systemtic Name: 3-[5-(2,4,6-trimethylpyridin-1-ium-1-yl)-1,3,4-thiadiazol-2-yl]propan-1-amine Openeye Name: 3-[5-(2,4,6-trimethylpyridin-1-ium-1-yl)-1,3,4-thiadiazol-2-yl]propan-1-amine CAS Name: 3-[5-(2,4,6-trimethyl-1-pyridin-1-iumyl)-1,3,4-thiadiazol-2-yl]-1-propanamine IUPAC Name: 3-[5-(2,4,6-trimethylpyridin-1-ium-1-yl)-1,3,4-thiadiazol-2-yl]propan-1-amine Traditional Name: 3-[5-(2,4,6-trimethylpyridin-1-ium-1-yl)-1,3,4-thiadiazol-2-yl]propylamine Formula: C13H19N4S+ MolecularWeight: 263.38176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](C(=C1)C)C2=NN=C(S2)CCCN)C

Isomeric SMILES

CC1=CC(=[N+](C(=C1)C)C2=NN=C(S2)CCCN)C

InChI

InChI=1S/C13H19N4S/c1-9-7-10(2)17(11(3)8-9)13-16-15-12(18-13)5-4-6-14/h7-8H,4-6,14H2,1-3H3/q+1