Vitas-M small molecule compound
3-{[3-(piperidin-1-ylcarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}bicyclo[2.2.2]octane-2-carboxylic acid
Catalog ID
STK470857
SMILES OC(=O)C1C2CCC(C1C(=O)Nc1sc3c(c1C(=O)N1CCCCC1)CCCC3)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 C24H32N2O4S MW 444.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H32N2O4S/c27-21(18-14-8-10-15(11-9-14)19(18)24(29)30)25-22-20(16-6-2-3-7-17(16)31-22)23(28)26-12-4-1-5-13-26/h14-15,18-19H,1-13H2,(H,25,27)(H,29,30)InChIKey
NKEOQCWUXVQESO-UHFFFAOYSA-NSynonyms
2((3(piperidine1carbonyl)4567tetrahydro1benzothiophen2yl)carbamoyl)bicyclo(222)octane3carboxylicacid
3((3(piperidin1ylcarbonyl)4567tetrahydro1benzothiophen2yl)carbamoyl)bicyclo(222)octane2carboxylicacid
C1CCN(CC1)C(=O)C2=C(SC3=C2CCCC3)NC(=O)C4C5CCC(C4C(=O)O)CC5
InChI=1SC24H32N2O4Sc2721(181481015(11914)19(18)24(29)30)252220(16623717(16)3122)23(28)26124151326h14151819H113H2(H2527)(H2930)
MFCD06021202
ZINC000019641700
ZINC000019641713
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