Vitas-M small molecule compound
4-{[3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)propanoyl]amino}benzoic acid
Catalog ID
STK115173
SMILES O=C(Nc1ccc(cc1)C(=O)O)CCN1C(=O)c2c(S1(=O)=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 C17H14N2O6S MW 374.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N2O6S/c20-15(18-12-7-5-11(6-8-12)17(22)23)9-10-19-16(21)13-3-1-2-4-14(13)26(19,24)25/h1-8H,9-10H2,(H,18,20)(H,22,23)InChIKey
BMVMVAXPOKNZPJ-UHFFFAOYSA-NSynonyms
4((3(11DIOXIDO3OXO12BENZISOTHIAZOL2(3H)YL)PROPANOYL)AMINO)BENZOICACID
4((3(11DIOXIDO3OXO12BENZOTHIAZOL2(3H)YL)PROPANOYL)AMINO)BENZOICACID
4(3(113TRIOXO12BENZOTHIAZOL2YL)PROPANOYLAMINO)BENZOICACID
C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)CCC(=O)NC3=CC=C(C=C3)C(=O)O
InChI=1SC17H14N2O6Sc2015(18127511(6812)17(22)23)9101916(21)13312414(13)26(1924)25h18H910H2(H1820)(H2223)
MFCD05149520
ZINC000001462450
ZINC1462450
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