Vitas-M small molecule compound
3-(4-fluorobenzyl)-2-[(3-fluoro-4-methoxybenzyl)sulfanyl]thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL143368
SMILES COc1ccc(cc1F)CSc1nc2ccsc2c(=O)n1Cc1ccc(cc1)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 C21H16F2N2O2S2 MW 430.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16F2N2O2S2/c1-27-18-7-4-14(10-16(18)23)12-29-21-24-17-8-9-28-19(17)20(26)25(21)11-13-2-5-15(22)6-3-13/h2-10H,11-12H2,1H3InChIKey
PFJBDZNXMJPETJ-UHFFFAOYSA-NSynonyms
2((3fluoro4methoxyphenyl)methylsulfanyl)3((4fluorophenyl)methyl)thieno(32d)pyrimidin4one
3(4fluorobenzyl)2((3fluoro4methoxybenzyl)sulfanyl)thieno(32d)pyrimidin4(3H)one
COC1=C(C=C(C=C1)CSC2=NC3=C(C(=O)N2CC4=CC=C(C=C4)F)SC=C3)F
InChI=1SC21H16F2N2O2S2c127187414(1016(18)23)1229212417892819(17)20(26)25(21)11132515(22)6313h210H1112H21H3
MFCD20749154
ZINC000071327580
ZINC71327580
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