Vitas-M small molecule compound
3-({[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetyl}amino)-4-methylbenzoic acid
Catalog ID
STK246999
SMILES CCOc1ccc2c(c1)sc(n2)SCC(=O)Nc1cc(ccc1C)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 C19H18N2O4S2 MW 402.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O4S2/c1-3-25-13-6-7-14-16(9-13)27-19(21-14)26-10-17(22)20-15-8-12(18(23)24)5-4-11(15)2/h4-9H,3,10H2,1-2H3,(H,20,22)(H,23,24)InChIKey
MZMRMTUXGLAJPP-UHFFFAOYSA-NSynonyms
878726-88-63((((6ETHOXY13BENZOTHIAZOL2YL)SULFANYL)ACETYL)AMINO)4METHYLBENZOICACID
3((2((6ETHOXY13BENZOTHIAZOL2YL)SULFANYL)ACETYL)AMINO)4METHYLBENZOICACID
3(2(6ETHOXYBENZOTHIAZOL2YLSULFANYL)ACETYLAMINO)4METHYLBENZOICACID
3(2(6ETHOXYBENZOTHIAZOL2YLTHIO)ACETYLAMINO)4METHYLBENZOICACID
878726886
CCOC1=CC2=C(C=C1)N=C(S2)SCC(=O)NC3=C(C=CC(=C3)C(=O)O)C
InChI=1SC19H18N2O4S2c132513671416(913)2719(2114)261017(22)2015812(18(23)24)5411(15)2h49H310H212H3(H2022)(H2324)
MFCD02018600
ZINC000005059912
ZINC5059912
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