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7-(azocan-1-ium-1-ylmethyl)-2-ethyl-8H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-4-ium-5-one
7-(azocan-1-ium-1-ylmethyl)-2-ethyl-8H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-4-ium-5-one
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Descriptors Computed from Structure
Canonical SMILES:
CCC1=N[N+]2=C(S1)NC(=CC2=O)C[NH+]3CCCCCCC3
Isomeric SMILES
CCC1=N[N+]2=C(S1)NC(=CC2=O)C[NH+]3CCCCCCC3
InChI
InChI=1S/C15H22N4OS/c1-2-13-17-19-14(20)10-12(16-15(19)21-13)11-18-8-6-4-3-5-7-9-18/h10H,2-9,11H2,1H3/p+2
Other Product
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- 3-(3-hydroxyphenyl)propanoic acid
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- 7-(azocan-1-ylmethyl)-2-ethyl-8H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-4-ium-5-one
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- 1-butyl-3-[2-(4-methylphenyl)sulfanylethyl]-4,10-dihydro-2H-[1,3,5]triazino[1,2-a]benzimidazol-1-ium
- 1-(phenylmethyl)-3-[2-(4-propan-2-ylphenyl)ethyl]-4,10-dihydro-2H-[1,3,5]triazino[1,2-a]benzimidazol-1-ium
- 1-butyl-3-[2-(4-propan-2-ylphenyl)ethyl]-4,10-dihydro-2H-[1,3,5]triazino[1,2-a]benzimidazol-1-ium
- (Z)-1-ethoxy-4-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-but-1-en-1-olate
- ethyl 4-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-2-(4-methyl-3H-1,3-thiazol-2-ylidene)-3-oxidanylidene-butanoate
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