Vitas-M small molecule compound
4-{(Z)-[2-(3-methoxyphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl 4-chlorobenzenesulfonate
Catalog ID
STL420172
SMILES COc1cccc(c1)C1=N/C(=C\c2ccc(cc2)OS(=O)(=O)c2ccc(cc2)Cl)/C(=O)O1
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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 C23H16ClNO6S MW 469.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16ClNO6S/c1-29-19-4-2-3-16(14-19)22-25-21(23(26)30-22)13-15-5-9-18(10-6-15)31-32(27,28)20-11-7-17(24)8-12-20/h2-14H,1H3/b21-13-InChIKey
XWOOCWXWMMWAAF-BKUYFWCQSA-NSynonyms
(4((Z)(2(3METHOXYPHENYL)5OXO13OXAZOL4YLIDENE)METHYL)PHENYL)4CHLOROBENZENESULFONATE
4((Z)(2(3methoxyphenyl)5oxo13oxazol4(5H)ylidene)methyl)phenyl4chlorobenzenesulfonate
COC1=CC=CC(=C1)C2=NC(=CC3=CC=C(C=C3)OS(=O)(=O)C4=CC=C(C=C4)Cl)C(=O)O2
COc1cccc(c1)C1=NC(=Cc2ccc(cc2)OS(=O)(=O)c2ccc(cc2)Cl)C(=O)O1
InChI=1SC23H16ClNO6Sc1291942316(1419)222521(23(26)3022)13155918(10615)3132(2728)2011717(24)81220h214H1H3b2113
MFCD03552913
ZINC000022364263
ZINC22364263
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