Vitas-M small molecule compound
2-chloro-4-[(propanoylcarbamothioyl)amino]benzoic acid
Catalog ID
STK050013
SMILES CCC(=O)NC(=S)Nc1ccc(c(c1)Cl)C(=O)O
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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 C11H11ClN2O3S MW 286.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11ClN2O3S/c1-2-9(15)14-11(18)13-6-3-4-7(10(16)17)8(12)5-6/h3-5H,2H2,1H3,(H,16,17)(H2,13,14,15,18)InChIKey
HABCFLSQMOIKCW-UHFFFAOYSA-NSynonyms
535948-43-72CHLORO4((PROPANOYLCARBAMOTHIOYL)AMINO)BENZOICACID
2CHLORO4(PROPANOYLCARBAMOTHIOYLAMINO)BENZOICACID
535948437
CCC(=O)NC(=S)NC1=CC(=C(C=C1)C(=O)O)Cl
CCC(=O)NC(=S)Nc1ccc(c(c1)Cl)C(=O)O
InChI=1SC11H11ClN2O3Sc129(15)1411(18)136347(10(16)17)8(12)56h35H2H21H3(H1617)(H213141518)
MFCD03453812
STK050013
ZINC000000312201
ZINC312201
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