Vitas-M small molecule compound
5-methyl-2-(propan-2-yl)phenyl 5-chloro-2-[(4-fluorobenzyl)sulfanyl]pyrimidine-4-carboxylate
Catalog ID
STL211785
SMILES Fc1ccc(cc1)CSc1ncc(c(n1)C(=O)Oc1cc(C)ccc1C(C)C)Cl
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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 C22H20ClFN2O2S MW 430.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClFN2O2S/c1-13(2)17-9-4-14(3)10-19(17)28-21(27)20-18(23)11-25-22(26-20)29-12-15-5-7-16(24)8-6-15/h4-11,13H,12H2,1-3H3InChIKey
VHDAKSPULLAPNX-UHFFFAOYSA-NSynonyms
(5methyl2propan2ylphenyl)5chloro2((4fluorophenyl)methylsulfanyl)pyrimidine4carboxylate
5methyl2(propan2yl)phenyl5chloro2((4fluorobenzyl)sulfanyl)pyrimidine4carboxylate
CC1=CC(=C(C=C1)C(C)C)OC(=O)C2=NC(=NC=C2Cl)SCC3=CC=C(C=C3)F
InChI=1SC22H20ClFN2O2Sc113(2)179414(3)1019(17)2821(27)2018(23)112522(2620)2912155716(24)8615h41113H12H213H3
MFCD18076673
ZINC000028290486
ZINC28290486
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