Vitas-M small molecule compound
N-(3-chloro-4-fluorobenzyl)-2-[3-(2-methoxybenzyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetamide
Catalog ID
STL091608
SMILES COc1ccccc1Cn1c(=O)n(CC(=O)NCc2ccc(c(c2)Cl)F)c2c(c1=O)scc2
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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 C23H19ClFN3O4S MW 487.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19ClFN3O4S/c1-32-19-5-3-2-4-15(19)12-28-22(30)21-18(8-9-33-21)27(23(28)31)13-20(29)26-11-14-6-7-17(25)16(24)10-14/h2-10H,11-13H2,1H3,(H,26,29)InChIKey
HUDDLXPQLJXVOQ-UHFFFAOYSA-NSynonyms
COC1=CC=CC=C1CN2C(=O)C3=C(C=CS3)N(C2=O)CC(=O)NCC4=CC(=C(C=C4)F)Cl
InChI=1SC23H19ClFN3O4Sc13219532415(19)122822(30)2118(893321)27(23(28)31)1320(29)2611146717(25)16(24)1014h210H1113H21H3(H2629)
MFCD18786054
N((3chloro4fluorophenyl)methyl)2(3((2methoxyphenyl)methyl)24dioxothieno(32d)pyrimidin1yl)acetamide
N(3chloro4fluorobenzyl)2(3(2methoxybenzyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)acetamide
ZINC000067205636
ZINC67205636
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