Vitas-M small molecule compound
N-(butan-2-yl)-2-[3-(4-ethoxybenzyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetamide
Catalog ID
STL031194
SMILES CCOc1ccc(cc1)Cn1c(=O)c2sccc2n(c1=O)CC(=O)NC(CC)C
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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 C21H25N3O4S MW 415.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O4S/c1-4-14(3)22-18(25)13-23-17-10-11-29-19(17)20(26)24(21(23)27)12-15-6-8-16(9-7-15)28-5-2/h6-11,14H,4-5,12-13H2,1-3H3,(H,22,25)InChIKey
HJQIQSUMJQXEPR-UHFFFAOYSA-NSynonyms
CCC(C)NC(=O)CN1C2=C(C(=O)N(C1=O)CC3=CC=C(C=C3)OCC)SC=C2
InChI=1SC21H25N3O4Sc1414(3)2218(25)13231710112919(17)20(26)24(21(23)27)12156816(9715)2852h61114H451213H213H3(H2225)
MFCD18191258
N(butan2yl)2(3(4ethoxybenzyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)acetamide
Nbutan2yl2(3((4ethoxyphenyl)methyl)24dioxothieno(32d)pyrimidin1yl)acetamide
ZINC000057428130
ZINC000057428134
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