Vitas-M small molecule compound
ethyl 4-[({[3-(3-chlorophenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL076044
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CSc1nc2ccsc2c(=O)n1c1cccc(c1)Cl
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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 C23H18ClN3O4S2 MW 500.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClN3O4S2/c1-2-31-22(30)14-6-8-16(9-7-14)25-19(28)13-33-23-26-18-10-11-32-20(18)21(29)27(23)17-5-3-4-15(24)12-17/h3-12H,2,13H2,1H3,(H,25,28)InChIKey
XMPWDFBAHVCZFD-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2C4=CC(=CC=C4)Cl)SC=C3
ethyl4((((3(3chlorophenyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
ethyl4((2(3(3chlorophenyl)4oxothieno(32d)pyrimidin2yl)sulfanylacetyl)amino)benzoate
InChI=1SC23H18ClN3O4S2c123122(30)146816(9714)2519(28)133323261810113220(18)21(29)27(23)1753415(24)1217h312H213H21H3(H2528)
MFCD18197295
ZINC000067216562
ZINC67216562
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