Vitas-M small molecule compound
methyl 2-({[3-(2-fluorophenyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetyl}amino)benzoate
Catalog ID
STL077190
SMILES COC(=O)c1ccccc1NC(=O)Cn1c2ccsc2c(=O)n(c1=O)c1ccccc1F
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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 C22H16FN3O5S MW 453.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16FN3O5S/c1-31-21(29)13-6-2-4-8-15(13)24-18(27)12-25-17-10-11-32-19(17)20(28)26(22(25)30)16-9-5-3-7-14(16)23/h2-11H,12H2,1H3,(H,24,27)InChIKey
OKZORWMAJCPBHQ-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=CC=C1NC(=O)CN2C3=C(C(=O)N(C2=O)C4=CC=CC=C4F)SC=C3
InChI=1SC22H16FN3O5Sc13121(29)13624815(13)2418(27)12251710113219(17)20(28)26(22(25)30)16953714(16)23h211H12H21H3(H2427)
methyl2(((3(2fluorophenyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)acetyl)amino)benzoate
methyl2((2(3(2fluorophenyl)24dioxothieno(32d)pyrimidin1yl)acetyl)amino)benzoate
MFCD18198417
ZINC000057490401
ZINC57490401
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