Vitas-M small molecule compound
3-({4-[(3,4-dimethylphenyl)sulfonyl]piperazin-1-yl}carbonyl)bicyclo[2.2.2]octane-2-carboxylic acid
Catalog ID
STK471140
SMILES OC(=O)C1C2CCC(C1C(=O)N1CCN(CC1)S(=O)(=O)c1ccc(c(c1)C)C)CC2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H30N2O5S MW 434.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N2O5S/c1-14-3-8-18(13-15(14)2)30(28,29)24-11-9-23(10-12-24)21(25)19-16-4-6-17(7-5-16)20(19)22(26)27/h3,8,13,16-17,19-20H,4-7,9-12H2,1-2H3,(H,26,27)InChIKey
FZACPAHLSHTZRZ-UHFFFAOYSA-NSynonyms
2(4(34dimethylphenyl)sulfonylpiperazine1carbonyl)bicyclo(222)octane3carboxylicacid
3((4((34dimethylphenyl)sulfonyl)piperazin1yl)carbonyl)bicyclo(222)octane2carboxylicacid
3((4((34DIMETHYLPHENYL)SULFONYL)PIPERAZINYL)CARBONYL)BICYCLO(222)OCTANE2CARBOXYLICACID
CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3C4CCC(C3C(=O)O)CC4)C
InChI=1SC22H30N2O5Sc1143818(1315(14)2)30(2829)2411923(101224)21(25)19164617(7516)20(19)22(26)27h381316171920H47912H212H3(H2627)
MFCD06024118
ZINC000017099017
ZINC000017099020
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