Vitas-M small molecule compound
ethyl N-({[3-(4-chlorophenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)glycinate
Catalog ID
STK555667
SMILES CCOC(=O)CNC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Cl)CCCC3
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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 C22H22ClN3O4S2 MW 492.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN3O4S2/c1-2-30-18(28)11-24-17(27)12-31-22-25-20-19(15-5-3-4-6-16(15)32-20)21(29)26(22)14-9-7-13(23)8-10-14/h7-10H,2-6,11-12H2,1H3,(H,24,27)InChIKey
HYAQYSSQHHDXGG-UHFFFAOYSA-NSynonyms
754228-10-9754228109
CCOC(=O)CNC(=O)CSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4=CC=C(C=C4)Cl
ethyl2((2((3(4chlorophenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetyl)amino)acetate
ethyl2(2((3(4chlorophenyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamido)acetate
ethylN(((3(4chlorophenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetyl)glycinate
InChI=1SC22H22ClN3O4S2c123018(28)112417(27)123122252019(15534616(15)3220)21(29)26(22)149713(23)81014h710H261112H21H3(H2427)
MFCD03474037
ZINC000002409234
ZINC02409234
ZINC2409234
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