Vitas-M small molecule compound
N-benzyl-2-[5-oxo-2-(pyridin-4-yl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-6(5H)-yl]acetamide
Catalog ID
STK643523
SMILES O=C(Cn1c(=O)n2nc(nc2c2c1sc1c2CCCC1)c1ccncc1)NCc1ccccc1
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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 C25H22N6O2S MW 470.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N6O2S/c32-20(27-14-16-6-2-1-3-7-16)15-30-24-21(18-8-4-5-9-19(18)34-24)23-28-22(29-31(23)25(30)33)17-10-12-26-13-11-17/h1-3,6-7,10-13H,4-5,8-9,14-15H2,(H,27,32)InChIKey
KLSXZLAJCLKNNR-UHFFFAOYSA-NSynonyms
1010921-98-81010921988
C1CCC2=C(C1)C3=C(S2)N(C(=O)N4C3=NC(=N4)C5=CC=NC=C5)CC(=O)NCC6=CC=CC=C6
InChI=1SC25H22N6O2Sc3220(2714166213716)15302421(18845919(18)3424)232822(2931(23)25(30)33)17101226131117h13671013H45891415H2(H2732)
MFCD12202905
Nbenzyl2(5oxo2(pyridin4yl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidin6(5H)yl)acetamide
Nbenzyl2(5oxo2(pyridin4yl)891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(15c)pyrimidin6(5H)yl)acetamide
ZINC000012391503
ZINC12391503
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