Vitas-M small molecule compound
methyl 4-({[5-chloro-2-(prop-2-en-1-ylsulfanyl)pyrimidin-4-yl]carbonyl}amino)benzoate
Catalog ID
STK912218
SMILES C=CCSc1ncc(c(n1)C(=O)Nc1ccc(cc1)C(=O)OC)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 C16H14ClN3O3S MW 363.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClN3O3S/c1-3-8-24-16-18-9-12(17)13(20-16)14(21)19-11-6-4-10(5-7-11)15(22)23-2/h3-7,9H,1,8H2,2H3,(H,19,21)InChIKey
ALJYNDFERLDDRO-UHFFFAOYSA-NSynonyms
874193-08-5874193085
COC(=O)C1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2Cl)SCC=C
InChI=1SC16H14ClN3O3Sc138241618912(17)13(2016)14(21)19116410(5711)15(22)232h379H18H22H3(H1921)
methyl4(((5chloro2(prop2en1ylsulfanyl)pyrimidin4yl)carbonyl)amino)benzoate
methyl4((5chloro2prop2enylsulfanylpyrimidine4carbonyl)amino)benzoate
MFCD07427152
ZINC000008916844
ZINC08916844
ZINC8916844
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