2-(1-methylpyridin-1-ium-4-yl)-5-phenyl-1,3,4-thiadiazole

Systemtic Name: 2-(1-methylpyridin-1-ium-4-yl)-5-phenyl-1,3,4-thiadiazole Openeye Name: 2-(1-methylpyridin-1-ium-4-yl)-5-phenyl-1,3,4-thiadiazole CAS Name: 2-(1-methyl-4-pyridin-1-iumyl)-5-phenyl-1,3,4-thiadiazole IUPAC Name: 2-(1-methylpyridin-1-ium-4-yl)-5-phenyl-1,3,4-thiadiazole Traditional Name: 2-(1-methylpyridin-1-ium-4-yl)-5-phenyl-1,3,4-thiadiazole Formula: C14H12N3S+ MolecularWeight: 254.33018

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C2=NN=C(S2)C3=CC=CC=C3

Isomeric SMILES

C[N+]1=CC=C(C=C1)C2=NN=C(S2)C3=CC=CC=C3

InChI

InChI=1S/C14H12N3S/c1-17-9-7-12(8-10-17)14-16-15-13(18-14)11-5-3-2-4-6-11/h2-10H,1H3/q+1