Vitas-M small molecule compound
ethyl 4-({[2-(benzylsulfanyl)-5-chloropyrimidin-4-yl]carbonyl}amino)benzoate
Catalog ID
STK909211
SMILES CCOC(=O)c1ccc(cc1)NC(=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 C21H18ClN3O3S MW 427.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3O3S/c1-2-28-20(27)15-8-10-16(11-9-15)24-19(26)18-17(22)12-23-21(25-18)29-13-14-6-4-3-5-7-14/h3-12H,2,13H2,1H3,(H,24,26)InChIKey
BJRMWVMGWUEINN-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2Cl)SCC3=CC=CC=C3
ethyl4(((2(benzylsulfanyl)5chloropyrimidin4yl)carbonyl)amino)benzoate
ETHYL4((2BENZYLSULFANYL5CHLOROPYRIMIDINE4CARBONYL)AMINO)BENZOATE
InChI=1SC21H18ClN3O3Sc122820(27)1581016(11915)2419(26)1817(22)122321(2518)2913146435714h312H213H21H3(H2426)
MFCD06628705
ZINC000016447695
ZINC16447695
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