Vitas-M small molecule compound
methyl 2-[({[3-(4-fluorobenzyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL028560
SMILES COC(=O)c1ccccc1NC(=O)CSc1nc2ccsc2c(=O)n1Cc1ccc(cc1)F
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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 C23H18FN3O4S2 MW 483.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18FN3O4S2/c1-31-22(30)16-4-2-3-5-17(16)25-19(28)13-33-23-26-18-10-11-32-20(18)21(29)27(23)12-14-6-8-15(24)9-7-14/h2-11H,12-13H2,1H3,(H,25,28)InChIKey
MQENSKMZSYGYEL-UHFFFAOYSA-NSynonyms
1252926-96-71252926967
COC(=O)C1=CC=CC=C1NC(=O)CSC2=NC3=C(C(=O)N2CC4=CC=C(C=C4)F)SC=C3
InChI=1SC23H18FN3O4S2c13122(30)16423517(16)2519(28)133323261810113220(18)21(29)27(23)12146815(24)9714h211H1213H21H3(H2528)
methyl2((((3(4fluorobenzyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
methyl2((2(3((4fluorophenyl)methyl)4oxothieno(32d)pyrimidin2yl)sulfanylacetyl)amino)benzoate
MFCD18188951
ZINC000067689755
ZINC67689755
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