Vitas-M small molecule compound
2-methoxy-4-[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]phenyl benzenesulfonate
Catalog ID
STK868561
SMILES COc1cc(/C=C/C(=O)c2ccc(cc2)C)ccc1OS(=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 C23H20O5S MW 408.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20O5S/c1-17-8-12-19(13-9-17)21(24)14-10-18-11-15-22(23(16-18)27-2)28-29(25,26)20-6-4-3-5-7-20/h3-16H,1-2H3/b14-10+InChIKey
JMRKLDQGTOBZAP-GXDHUFHOSA-NSynonyms
1207326-96-2(2methoxy4((E)3(4methylphenyl)3oxoprop1enyl)phenyl)benzenesulfonate
1207326962
2methoxy4((1E)3(4methylphenyl)3oxoprop1en1yl)phenylbenzenesulfonate
CC1=CC=C(C=C1)C(=O)C=CC2=CC(=C(C=C2)OS(=O)(=O)C3=CC=CC=C3)OC
COc1cc(C=CC(=O)c2ccc(cc2)C)ccc1OS(=O)(=O)c1ccccc1
InChI=1SC23H20O5Sc11781219(13917)21(24)141018111522(23(1618)272)2829(2526)206435720h316H12H3b1410+
MFCD18170038
ZINC000039315685
ZINC39315685
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