Vitas-M small molecule compound
4-{(Z)-[2-(ethylsulfanyl)-5-oxo-1,3-thiazol-4(5H)-ylidene]methyl}benzoic acid
Catalog ID
STK509100
SMILES CCSC1=N/C(=C\c2ccc(cc2)C(=O)O)/C(=O)S1
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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 C13H11NO3S2 MW 293.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11NO3S2/c1-2-18-13-14-10(12(17)19-13)7-8-3-5-9(6-4-8)11(15)16/h3-7H,2H2,1H3,(H,15,16)/b10-7-InChIKey
PXOZZALUUBNNST-YFHOEESVSA-NSynonyms
4((2(ETHYLSULFANYL)5OXO13THIAZOL4(5H)YLIDENE)METHYL)BENZOICACID
4((Z)(2(ethylsulfanyl)5oxo13thiazol4(5H)ylidene)methyl)benzoicacid
4((Z)(2ETHYLSULFANYL5OXO13THIAZOL4YLIDENE)METHYL)BENZOICACID
CCSC1=NC(=CC2=CC=C(C=C2)C(=O)O)C(=O)S1
CCSC1=NC(=Cc2ccc(cc2)C(=O)O)C(=O)S1
InChI=1SC13H11NO3S2c1218131410(12(17)1913)78359(648)11(15)16h37H2H21H3(H1516)b107
MFCD01837031
ZINC000004660183
ZINC4660183
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