Vitas-M small molecule compound
3,4-dimethylphenyl 5-chloro-2-[(4-fluorobenzyl)sulfonyl]pyrimidine-4-carboxylate
Catalog ID
STL215503
SMILES Fc1ccc(cc1)CS(=O)(=O)c1ncc(c(n1)C(=O)Oc1ccc(c(c1)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 C20H16ClFN2O4S MW 434.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClFN2O4S/c1-12-3-8-16(9-13(12)2)28-19(25)18-17(21)10-23-20(24-18)29(26,27)11-14-4-6-15(22)7-5-14/h3-10H,11H2,1-2H3InChIKey
XSPMYRYDLFXKMB-UHFFFAOYSA-NSynonyms
(34dimethylphenyl)5chloro2((4fluorophenyl)methylsulfonyl)pyrimidine4carboxylate
34dimethylphenyl5chloro2((4fluorobenzyl)sulfonyl)pyrimidine4carboxylate
CC1=C(C=C(C=C1)OC(=O)C2=NC(=NC=C2Cl)S(=O)(=O)CC3=CC=C(C=C3)F)C
InChI=1SC20H16ClFN2O4Sc1123816(913(12)2)2819(25)1817(21)102320(2418)29(2627)11144615(22)7514h310H11H212H3
MFCD18079131
ZINC000032623411
ZINC32623411
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