Vitas-M small molecule compound
3-(4-fluorobenzyl)-2-[(3-fluoro-4-methoxybenzyl)sulfanyl]quinazolin-4(3H)-one
Catalog ID
STL106682
SMILES COc1ccc(cc1F)CSc1nc2ccccc2c(=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 C23H18F2N2O2S MW 424.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18F2N2O2S/c1-29-21-11-8-16(12-19(21)25)14-30-23-26-20-5-3-2-4-18(20)22(28)27(23)13-15-6-9-17(24)10-7-15/h2-12H,13-14H2,1H3InChIKey
KCVOGENFGRYKCP-UHFFFAOYSA-NSynonyms
2((3fluoro4methoxyphenyl)methylsulfanyl)3((4fluorophenyl)methyl)quinazolin4one
3(4fluorobenzyl)2((3fluoro4methoxybenzyl)sulfanyl)quinazolin4(3H)one
COC1=C(C=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)F)F
InChI=1SC23H18F2N2O2Sc1292111816(1219(21)25)1430232620532418(20)22(28)27(23)13156917(24)10715h212H1314H21H3
MFCD06888199
ZINC000067259279
ZINC67259279
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