Vitas-M small molecule compound
4-[4-(trifluoromethyl)phenyl]-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridin-2(1H)-one
Catalog ID
STK692865
SMILES O=C1Nc2sc3c(c2C(C1)c1ccc(cc1)C(F)(F)F)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 C18H16F3NOS MW 351.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16F3NOS/c19-18(20,21)11-7-5-10(6-8-11)13-9-15(23)22-17-16(13)12-3-1-2-4-14(12)24-17/h5-8,13H,1-4,9H2,(H,22,23)InChIKey
NJBCIUNOCNOJNZ-UHFFFAOYSA-NSynonyms
4(4(trifluoromethyl)phenyl)345678hexahydro(1)benzothieno(23b)pyridin2(1H)one
4(4(trifluoromethyl)phenyl)345678hexahydro1H(1)benzothiolo(23b)pyridin2one
C1CCC2=C(C1)C3=C(S2)NC(=O)CC3C4=CC=C(C=C4)C(F)(F)F
InChI=1SC18H16F3NOSc1918(2021)117510(6811)13915(23)221716(13)12312414(12)2417h5813H149H2(H2223)
MFCD10038888
ZINC000015085030
ZINC000015085032
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