Vitas-M small molecule compound
4-[(4-methylphenyl)sulfonyl]but-2-yn-1-yl 4-nitrobenzoate
Catalog ID
STK072208
SMILES Cc1ccc(cc1)S(=O)(=O)CC#CCOC(=O)c1ccc(cc1)[N+](=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 C18H15NO6S MW 373.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15NO6S/c1-14-4-10-17(11-5-14)26(23,24)13-3-2-12-25-18(20)15-6-8-16(9-7-15)19(21)22/h4-11H,12-13H2,1H3InChIKey
XFUYNASYVIGKBI-UHFFFAOYSA-NSynonyms
4((4METHYLPHENYL)SULFONYL)2BUTYN1YL4NITROBENZOATE
4((4METHYLPHENYL)SULFONYL)BUT2YN1YL4NITROBENZOATE
4(4METHYLPHENYL)SULFONYLBUT2YNYL4NITROBENZOATE
4NITROBENZOICACID4(4METHYLPHENYL)SULFONYLBUT2YNYLESTER
4NITROBENZOICACID4TOSYLBUT2YNYLESTER
CC1=CC=C(C=C1)S(=O)(=O)CC#CCOC(=O)C2=CC=C(C=C2)(N+)(=O)(O)
Cc1ccc(cc1)S(=O)(=O)CC#CCOC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC18H15NO6Sc11441017(11514)26(2324)1332122518(20)156816(9715)19(21)22h411H1213H21H3
MFCD01218661
STK072208
ZINC000002891850
ZINC02891850
ZINC2891850
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