Vitas-M small molecule compound
ethyl 2-[({1-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)sulfonyl]piperidin-3-yl}carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK310994
SMILES CCOC(=O)c1c(NC(=O)C2CCCN(C2)S(=O)(=O)c2cn(nc2C)CC)sc2c1CCC2
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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 C22H30N4O5S2 MW 494.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N4O5S2/c1-4-25-13-18(14(3)24-25)33(29,30)26-11-7-8-15(12-26)20(27)23-21-19(22(28)31-5-2)16-9-6-10-17(16)32-21/h13,15H,4-12H2,1-3H3,(H,23,27)InChIKey
RGLUKCWJLGKSSK-UHFFFAOYSA-NSynonyms
1005646-54-71005646547
CCN1C=C(C(=N1)C)S(=O)(=O)N2CCCC(C2)C(=O)NC3=C(C4=C(S3)CCC4)C(=O)OCC
ethyl2(((1((1ethyl3methyl1Hpyrazol4yl)sulfonyl)piperidin3yl)carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
ethyl2((1(1ethyl3methylpyrazol4yl)sulfonylpiperidine3carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
InChI=1SC22H30N4O5S2c14251318(14(3)2425)33(2930)26117815(1226)20(27)232119(22(28)3152)16961017(16)3221h1315H412H213H3(H2327)
MFCD04136859
ZINC000002808181
ZINC000002808182
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