Vitas-M small molecule compound
ethyl 2-({[1-methyl-3-(morpholin-4-ylcarbonyl)-1H-pyrazol-5-yl]carbonyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STL396942
SMILES CCOC(=O)c1c(NC(=O)c2cc(nn2C)C(=O)N2CCOCC2)sc2c1CCCCC2
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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 C22H28N4O5S MW 460.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O5S/c1-3-31-22(29)18-14-7-5-4-6-8-17(14)32-20(18)23-19(27)16-13-15(24-25(16)2)21(28)26-9-11-30-12-10-26/h13H,3-12H2,1-2H3,(H,23,27)InChIKey
KSWRPRHVHIEEOM-UHFFFAOYSA-NSynonyms
1006360-65-11006360651
CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=CC(=NN3C)C(=O)N4CCOCC4
ethyl2(((1methyl3(morpholin4ylcarbonyl)1Hpyrazol5yl)carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ethyl2((2methyl5(morpholine4carbonyl)pyrazole3carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC22H28N4O5Sc133122(29)18147546817(14)3220(18)2319(27)161315(2425(16)2)21(28)2691130121026h13H312H212H3(H2327)
MFCD08556941
ZINC000036612416
ZINC36612416
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