Vitas-M small molecule compound

2,4-dimethylphenyl 2-(benzylsulfanyl)-5-chloropyrimidine-4-carboxylate

Catalog ID
STK909898
SMILES Cc1ccc(c(c1)C)OC(=O)c1nc(ncc1Cl)SCc1ccccc1

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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 C20H17ClN2O2S MW 384.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN2O2S/c1-13-8-9-17(14(2)10-13)25-19(24)18-16(21)11-22-20(23-18)26-12-15-6-4-3-5-7-15/h3-11H,12H2,1-2H3
InChIKey
GDNRVFKOFAFEDE-UHFFFAOYSA-N
Synonyms

(24DIMETHYLPHENYL)2BENZYLSULFANYL5CHLOROPYRIMIDINE4CARBOXYLATE
24dimethylphenyl2(benzylsulfanyl)5chloropyrimidine4carboxylate
CC1=CC(=C(C=C1)OC(=O)C2=NC(=NC=C2Cl)SCC3=CC=CC=C3)C
InChI=1SC20H17ClN2O2Sc1138917(14(2)1013)2519(24)1816(21)112220(2318)2612156435715h311H12H212H3
MFCD06630725
ZINC000004811163
ZINC04811163
ZINC4811163

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Available files

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