Vitas-M small molecule compound
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Catalog ID
STL294537
SMILES O=C(Nc1ccc(c(c1)C(F)(F)F)Cl)CSc1nc2sc3c(c2c(=O)n1C)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 C20H17ClF3N3O2S2 MW 487.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClF3N3O2S2/c1-27-18(29)16-11-4-2-3-5-14(11)31-17(16)26-19(27)30-9-15(28)25-10-6-7-13(21)12(8-10)20(22,23)24/h6-8H,2-5,9H2,1H3,(H,25,28)InChIKey
UZLPFUSHVHFKHK-UHFFFAOYSA-NSynonyms
679831-54-0679831540
CN1C(=O)C2=C(N=C1SCC(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F)SC4=C2CCCC4
InChI=1SC20H17ClF3N3O2S2c12718(29)1611423514(11)3117(16)2619(27)30915(28)25106713(21)12(810)20(2223)24h68H259H21H3(H2528)
MFCD04013451
N(4chloro3(trifluoromethyl)phenyl)2((3methyl4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(4chloro3(trifluoromethyl)phenyl)2((3methyl4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamide
N(4chloro3(trifluoromethyl)phenyl)2((3methyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
ZINC000002233621
ZINC02233621
ZINC2233621
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