Vitas-M small molecule compound
7-tert-butyl-3-phenyl-2-{[3-(trifluoromethyl)benzyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK675584
SMILES O=c1c2c(sc3c2CCC(C3)C(C)(C)C)nc(n1c1ccccc1)SCc1cccc(c1)C(F)(F)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 C28H27F3N2OS2 MW 528.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27F3N2OS2/c1-27(2,3)18-12-13-21-22(15-18)36-24-23(21)25(34)33(20-10-5-4-6-11-20)26(32-24)35-16-17-8-7-9-19(14-17)28(29,30)31/h4-11,14,18H,12-13,15-16H2,1-3H3InChIKey
WLSVYZPPIRAJLC-UHFFFAOYSA-NSynonyms
7tertbutyl3phenyl2((3(trifluoromethyl)benzyl)sulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
7tertbutyl3phenyl2((3(trifluoromethyl)phenyl)methylsulfanyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC4=CC(=CC=C4)C(F)(F)F)C5=CC=CC=C5
InChI=1SC28H27F3N2OS2c127(23)1812132122(1518)362423(21)25(34)33(20105461120)26(3224)35161787919(1417)28(2930)31h4111418H12131516H213H3
MFCD01819509
ZINC000003669431
ZINC000003669432
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