Vitas-M small molecule compound
2-{(E)-[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl naphthalene-2-sulfonate
Catalog ID
STL383016
SMILES Cc1ccc(cc1)C1=N/C(=C/c2ccccc2OS(=O)(=O)c2ccc3c(c2)cccc3)/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 C27H19NO5S MW 469.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19NO5S/c1-18-10-12-20(13-11-18)26-28-24(27(29)32-26)17-22-8-4-5-9-25(22)33-34(30,31)23-15-14-19-6-2-3-7-21(19)16-23/h2-17H,1H3/b24-17+InChIKey
HBFPREOQBJJXGH-JJIBRWJFSA-NSynonyms
(2((E)(2(4METHYLPHENYL)5OXO13OXAZOL4YLIDENE)METHYL)PHENYL)NAPHTHALENE2SULFONATE
2((E)(2(4methylphenyl)5oxo13oxazol4(5H)ylidene)methyl)phenylnaphthalene2sulfonate
CC1=CC=C(C=C1)C2=NC(=CC3=CC=CC=C3OS(=O)(=O)C4=CC5=CC=CC=C5C=C4)C(=O)O2
Cc1ccc(cc1)C1=NC(=Cc2ccccc2OS(=O)(=O)c2ccc3c(c2)cccc3)C(=O)O1
InChI=1SC27H19NO5Sc118101220(131118)262824(27(29)3226)1722845925(22)3334(3031)23151419623721(19)1623h217H1H3b2417+
MFCD02581443
ZINC000002938777
ZINC02938777
ZINC2938777
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