Vitas-M small molecule compound
3-({[(3,6-diethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl}amino)-4-methylbenzoic acid
Catalog ID
STL431530
SMILES CCc1cc2c(s1)nc(n(c2=O)CC)SCC(=O)Nc1cc(ccc1C)C(=O)O
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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/c1-4-13-9-14-17(29-13)22-20(23(5-2)18(14)25)28-10-16(24)21-15-8-12(19(26)27)7-6-11(15)3/h6-9H,4-5,10H2,1-3H3,(H,21,24)(H,26,27)InChIKey
QTHCLHTUUJBBAZ-UHFFFAOYSA-NSynonyms
3((((36diethyl4oxo34dihydrothieno(23d)pyrimidin2yl)sulfanyl)acetyl)amino)4methylbenzoicacid
3((2(36diethyl4oxothieno(23d)pyrimidin2yl)sulfanylacetyl)amino)4methylbenzoicacid
CCC1=CC2=C(S1)N=C(N(C2=O)CC)SCC(=O)NC3=C(C=CC(=C3)C(=O)O)C
InChI=1SC20H21N3O4S2c141391417(2913)2220(23(52)18(14)25)281016(24)2115812(19(26)27)7611(15)3h69H4510H213H3(H2124)(H2627)
MFCD30502702
ZINC000013364783
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