Vitas-M small molecule compound
methyl 4-({[(3-butyl-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STL029860
SMILES CCCCn1c(SCC(=O)Nc2ccc(cc2)C(=O)OC)nc2c(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 C20H21N3O4S2 MW 431.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O4S2/c1-3-4-10-23-18(25)17-15(9-11-28-17)22-20(23)29-12-16(24)21-14-7-5-13(6-8-14)19(26)27-2/h5-9,11H,3-4,10,12H2,1-2H3,(H,21,24)InChIKey
LBBXWVSFSLYPET-UHFFFAOYSA-NSynonyms
1252917-25-11252917251
CCCCN1C(=O)C2=C(C=CS2)N=C1SCC(=O)NC3=CC=C(C=C3)C(=O)OC
InChI=1SC20H21N3O4S2c134102318(25)1715(9112817)2220(23)291216(24)21147513(6814)19(26)272h5911H341012H212H3(H2124)
methyl4((((3butyl4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
methyl4((2(3butyl4oxothieno(32d)pyrimidin2yl)sulfanylacetyl)amino)benzoate
MFCD18190136
ZINC000057426415
ZINC57426415
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