5-[4-(2,2-dimethylpropyl)-2,6-diethyl-pyridin-1-ium-1-yl]-3H-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-[4-(2,2-dimethylpropyl)-2,6-diethyl-pyridin-1-ium-1-yl]-3H-1,3,4-thiadiazole-2-thione Openeye Name: 5-[4-(2,2-dimethylpropyl)-2,6-diethyl-pyridin-1-ium-1-yl]-3H-1,3,4-thiadiazole-2-thione CAS Name: 5-[4-(2,2-dimethylpropyl)-2,6-diethyl-1-pyridin-1-iumyl]-3H-1,3,4-thiadiazole-2-thione IUPAC Name: 5-[4-(2,2-dimethylpropyl)-2,6-diethylpyridin-1-ium-1-yl]-3H-1,3,4-thiadiazole-2-thione Traditional Name: 5-(2,6-diethyl-4-neopentyl-pyridin-1-ium-1-yl)-3H-1,3,4-thiadiazole-2-thione Formula: C16H24N3S2+ MolecularWeight: 322.51186

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=[N+]1C2=NNC(=S)S2)CC)CC(C)(C)C

Isomeric SMILES

CCC1=CC(=CC(=[N+]1C2=NNC(=S)S2)CC)CC(C)(C)C

InChI

InChI=1S/C16H23N3S2/c1-6-12-8-11(10-16(3,4)5)9-13(7-2)19(12)14-17-18-15(20)21-14/h8-9H,6-7,10H2,1-5H3/p+1