Vitas-M small molecule compound
ethyl [5-oxo-2-(thiophen-2-yl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-6(5H)-yl]acetate
Catalog ID
STK933588
SMILES CCOC(=O)Cn1c(=O)n2nc(nc2c2c1sc1c2CCCC1)c1cccs1
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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 C19H18N4O3S2 MW 414.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O3S2/c1-2-26-14(24)10-22-18-15(11-6-3-4-7-12(11)28-18)17-20-16(13-8-5-9-27-13)21-23(17)19(22)25/h5,8-9H,2-4,6-7,10H2,1H3InChIKey
OCSDQAKCMJCMKZ-UHFFFAOYSA-NSynonyms
951969-25-8951969258
CCOC(=O)CN1C2=C(C3=C(S2)CCCC3)C4=NC(=NN4C1=O)C5=CC=CS5
ethyl(5oxo2(thiophen2yl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidin6(5H)yl)acetate
ethyl2(5oxo2(thiophen2yl)891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(15c)pyrimidin6(5H)yl)acetate
InChI=1SC19H18N4O3S2c122614(24)10221815(11634712(11)2818)172016(138592713)2123(17)19(22)25h589H246710H21H3
MFCD09851913
ZINC000013690609
ZINC13690609
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