Vitas-M small molecule compound
methyl 4-[({[3-(2-methylpropyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL029661
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nc2ccsc2c(=O)n1CC(C)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 C20H21N3O4S2 MW 431.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O4S2/c1-12(2)10-23-18(25)17-15(8-9-28-17)22-20(23)29-11-16(24)21-14-6-4-13(5-7-14)19(26)27-3/h4-9,12H,10-11H2,1-3H3,(H,21,24)InChIKey
IIQUNLBSIZWZEP-UHFFFAOYSA-NSynonyms
CC(C)CN1C(=O)C2=C(C=CS2)N=C1SCC(=O)NC3=CC=C(C=C3)C(=O)OC
InChI=1SC20H21N3O4S2c112(2)102318(25)1715(892817)2220(23)291116(24)21146413(5714)19(26)273h4912H1011H213H3(H2124)
methyl4((((3(2methylpropyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
methyl4((2(3(2methylpropyl)4oxothieno(32d)pyrimidin2yl)sulfanylacetyl)amino)benzoate
MFCD18189951
ZINC000057426271
ZINC57426271
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