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7-cyclohex-3-en-1-yl-2-methylsulfanyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
7-cyclohex-3-en-1-yl-2-methylsulfanyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
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Descriptors Computed from Structure
Canonical SMILES:
CSC1=NC2=NC(=CC(N2N1)C3CCC=CC3)C(=O)O
Isomeric SMILES
CSC1=NC2=NC(=CC(N2N1)C3CCC=CC3)C(=O)O
InChI
InChI=1S/C13H16N4O2S/c1-20-13-15-12-14-9(11(18)19)7-10(17(12)16-13)8-5-3-2-4-6-8/h2-3,7-8,10H,4-6H2,1H3,(H,18,19)(H,14,15,16)
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- 2-(5-methyl-1H-indol-3-yl)-2-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]ethanoic acid
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