Vitas-M small molecule compound
methyl 4-[({[3-(3-methoxybenzyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL029552
SMILES COc1cccc(c1)Cn1c(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 C24H21N3O5S2 MW 495.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O5S2/c1-31-18-5-3-4-15(12-18)13-27-22(29)21-19(10-11-33-21)26-24(27)34-14-20(28)25-17-8-6-16(7-9-17)23(30)32-2/h3-12H,13-14H2,1-2H3,(H,25,28)InChIKey
VOAVFNCPOODGSA-UHFFFAOYSA-NSynonyms
1252931-35-31252931353
COC1=CC=CC(=C1)CN2C(=O)C3=C(C=CS3)N=C2SCC(=O)NC4=CC=C(C=C4)C(=O)OC
InChI=1SC24H21N3O5S2c1311853415(1218)132722(29)2119(10113321)2624(27)341420(28)25178616(7917)23(30)322h312H1314H212H3(H2528)
methyl4((((3(3methoxybenzyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
methyl4((2(3((3methoxyphenyl)methyl)4oxothieno(32d)pyrimidin2yl)sulfanylacetyl)amino)benzoate
MFCD18189846
ZINC000067689958
ZINC67689958
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