Vitas-M small molecule compound
ethyl 4-{[4-(3-oxo-1,2-benzothiazol-2(3H)-yl)butanoyl]amino}benzoate
Catalog ID
STK928074
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CCCn1sc2c(c1=O)cccc2
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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 C20H20N2O4S MW 384.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O4S/c1-2-26-20(25)14-9-11-15(12-10-14)21-18(23)8-5-13-22-19(24)16-6-3-4-7-17(16)27-22/h3-4,6-7,9-12H,2,5,8,13H2,1H3,(H,21,23)InChIKey
ICCCXOWKNLSJMB-UHFFFAOYSA-NSynonyms
931954-32-4931954324
CCOC(=O)C1=CC=C(C=C1)NC(=O)CCCN2C(=O)C3=CC=CC=C3S2
ethyl4((4(3oxo12benzothiazol2(3H)yl)butanoyl)amino)benzoate
ethyl4(4(3oxo12benzothiazol2yl)butanoylamino)benzoate
ethyl4(4(3oxobenzo(d)isothiazol2(3H)yl)butanamido)benzoate
InChI=1SC20H20N2O4Sc122620(25)1491115(121014)2118(23)85132219(24)16634717(16)2722h3467912H25813H21H3(H2123)
MFCD13757096
ZINC000009289835
ZINC09289835
ZINC9289835
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