Vitas-M small molecule compound
2-hydroxy-5-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}benzoic acid
Catalog ID
STK696271
SMILES COc1ccccc1N1CCN(CC1)S(=O)(=O)c1ccc(c(c1)C(=O)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 C18H20N2O6S MW 392.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O6S/c1-26-17-5-3-2-4-15(17)19-8-10-20(11-9-19)27(24,25)13-6-7-16(21)14(12-13)18(22)23/h2-7,12,21H,8-11H2,1H3,(H,22,23)InChIKey
ZFZCNAZTSHUFFT-UHFFFAOYSA-NSynonyms
2hydroxy5((4(2methoxyphenyl)piperazin1yl)sulfonyl)benzoicacid
2HYDROXY5(4(2METHOXYPHENYL)PIPERAZIN1YL)SULFONYLBENZOICACID
COC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)O)C(=O)O
InChI=1SC18H20N2O6Sc12617532415(17)1981020(11919)27(2425)136716(21)14(1213)18(22)23h271221H811H21H3(H2223)
MFCD04563621
ZINC000005545029
ZINC5545029
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