Vitas-M small molecule compound
ethyl 3-({[4-(2-hydroxyethyl)piperazin-1-yl]carbonyl}amino)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxylate
Catalog ID
STL238160
SMILES OCCN1CCN(CC1)C(=O)Nc1c(sc2c1cc1CCCc1n2)C(=O)OCC
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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 C20H26N4O4S MW 418.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N4O4S/c1-2-28-19(26)17-16(14-12-13-4-3-5-15(13)21-18(14)29-17)22-20(27)24-8-6-23(7-9-24)10-11-25/h12,25H,2-11H2,1H3,(H,22,27)InChIKey
XAWUBOBZWGTEGM-UHFFFAOYSA-NSynonyms
929848-97-5929848975
CCOC(=O)C1=C(C2=CC3=C(CCC3)N=C2S1)NC(=O)N4CCN(CC4)CCO
ethyl3(((4(2hydroxyethyl)piperazin1yl)carbonyl)amino)67dihydro5Hcyclopenta(b)thieno(32e)pyridine2carboxylate
ethyl3(4(2hydroxyethyl)piperazine1carboxamido)67dihydro5Hcyclopenta(b)thieno(32e)pyridine2carboxylate
InChI=1SC20H26N4O4Sc122819(26)1716(14121343515(13)2118(14)2917)2220(27)248623(7924)101125h1225H211H21H3(H2227)
MFCD09844657
ZINC000020646469
ZINC20646469
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