Vitas-M small molecule compound
2-[(E)-(5-oxo-2-phenyl-1,3-oxazol-4(5H)-ylidene)methyl]phenyl 2-nitrobenzenesulfonate
Catalog ID
STK075589
SMILES O=C1OC(=N/C/1=C/c1ccccc1OS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1
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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 C22H14N2O7S MW 450.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14N2O7S/c25-22-17(23-21(30-22)15-8-2-1-3-9-15)14-16-10-4-6-12-19(16)31-32(28,29)20-13-7-5-11-18(20)24(26)27/h1-14H/b17-14+InChIKey
LWGKXYKLOOEBBJ-SAPNQHFASA-NSynonyms
(2((E)(5OXO2PHENYL13OXAZOL4YLIDENE)METHYL)PHENYL)2NITROBENZENESULFONATE
2((E)(5OXO2PHENYL13OXAZOL4(5H)YLIDENE)METHYL)PHENYL2NITROBENZENESULFONATE
C1=CC=C(C=C1)C2=NC(=CC3=CC=CC=C3OS(=O)(=O)C4=CC=CC=C4(N+)(=O)(O))C(=O)O2
InChI=1SC22H14N2O7Sc252217(2321(3022)158213915)141610461219(16)3132(2829)2013751118(20)24(26)27h114Hb1714+
MFCD03227966
O=C1OC(=NC1=Cc1ccccc1OS(=O)(=O)c1ccccc1(N+)(=O)(O))c1ccccc1
STK075589
ZINC000002985728
ZINC02985728
ZINC2985728
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