Vitas-M small molecule compound
ethyl 4-({[3-(2-methylpropyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetyl}amino)benzoate
Catalog ID
STL073832
SMILES CCOC(=O)c1ccc(cc1)NC(=O)Cn1c(=O)n(CC(C)C)c(=O)c2c1ccs2
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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 C21H23N3O5S MW 429.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O5S/c1-4-29-20(27)14-5-7-15(8-6-14)22-17(25)12-23-16-9-10-30-18(16)19(26)24(21(23)28)11-13(2)3/h5-10,13H,4,11-12H2,1-3H3,(H,22,25)InChIKey
ADBABYSASWFPJK-UHFFFAOYSA-NSynonyms
1260632-16-31260632163
CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C3=C(C(=O)N(C2=O)CC(C)C)SC=C3
ethyl4(((3(2methylpropyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)acetyl)amino)benzoate
ethyl4((2(3(2methylpropyl)24dioxothieno(32d)pyrimidin1yl)acetyl)amino)benzoate
InChI=1SC21H23N3O5Sc142920(27)145715(8614)2217(25)1223169103018(16)19(26)24(21(23)28)1113(2)3h51013H41112H213H3(H2225)
MFCD18195276
ZINC000057486026
ZINC57486026
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