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4-ethanoyl-3-methyl-1-[4-[4-(methylamino)pent-2-ynoxy]phenyl]sulfonyl-piperazine-2-carboxylic acid
4-ethanoyl-3-methyl-1-[4-[4-(methylamino)pent-2-ynoxy]phenyl]sulfonyl-piperazine-2-carboxylic acid
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Descriptors Computed from Structure
Canonical SMILES:
CC1C(N(CCN1C(=O)C)S(=O)(=O)C2=CC=C(C=C2)OCC#CC(C)NC)C(=O)O
Isomeric SMILES
CC1C(N(CCN1C(=O)C)S(=O)(=O)C2=CC=C(C=C2)OCC#CC(C)NC)C(=O)O
InChI
InChI=1S/C20H27N3O6S/c1-14(21-4)6-5-13-29-17-7-9-18(10-8-17)30(27,28)23-12-11-22(16(3)24)15(2)19(23)20(25)26/h7-10,14-15,19,21H,11-13H2,1-4H3,(H,25,26)
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- 4-[[2-[[4-(3-methylphenyl)-3-oxidanylidene-piperazin-1-yl]methyl]imidazol-1-yl]methyl]benzenecarbonitrile
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- 4-[[5-[[4-(3-chlorophenyl)-3-oxidanylidene-piperazin-1-yl]methyl]imidazol-1-yl]methyl]-2-(trifluoromethyloxy)benzenecarbonitrile
- 5-oxidanyl-1-[4-(4-oxidanylhex-2-ynoxy)phenyl]sulfonyl-piperidine-2-carboxylic acid
- 4-[4-(4-azanylpent-2-ynoxy)phenyl]sulfonyl-2,6-dimethyl-morpholine-3-carboxylic acid
- 2-methyl-4-(4-pent-2-ynoxyphenyl)sulfonyl-piperazine-1,3-dicarboxylic acid
- 1-[4-[4-[ethyl(methyl)amino]pent-2-ynoxy]phenyl]sulfonyl-5-oxidanyl-piperidine-2-carboxylic acid
- 2,6-dimethyl-4-[4-(4-oxidanylhex-2-ynoxy)phenyl]sulfonyl-morpholine-3-carboxylic acid
