Vitas-M small molecule compound
ethyl [(5-phenyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetate
Catalog ID
STK720319
SMILES CCOC(=O)CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1
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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 C21H20N4O2S2 MW 424.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O2S2/c1-2-27-16(26)12-28-21-24-23-19-17-14-10-6-7-11-15(14)29-20(17)22-18(25(19)21)13-8-4-3-5-9-13/h3-5,8-9H,2,6-7,10-12H2,1H3InChIKey
VJCXVBLXWHOSGE-UHFFFAOYSA-NSynonyms
500275-55-8500275558
CCOC(=O)CSC1=NN=C2N1C(=NC3=C2C4=C(S3)CCCC4)C5=CC=CC=C5
ethyl((5phenyl891011tetrahydro(1)benzothieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)acetate
ethyl2((5phenyl891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)acetate
InChI=1SC21H20N4O2S2c122716(26)122821242319171410671115(14)2920(17)2218(25(19)21)138435913h3589H2671012H21H3
MFCD03303183
ZINC000002354352
ZINC02354352
ZINC2354352
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