Vitas-M small molecule compound
3-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)phenyl thiophene-2-carboxylate
Catalog ID
STK253472
SMILES O=C1N(c2cccc(c2)OC(=O)c2cccs2)C(=O)C2C1C1C=CC2C2C1C2
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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 C22H17NO4S MW 391.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17NO4S/c24-20-18-13-6-7-14(16-10-15(13)16)19(18)21(25)23(20)11-3-1-4-12(9-11)27-22(26)17-5-2-8-28-17/h1-9,13-16,18-19H,10H2InChIKey
XOKDEVYCBJLIER-UHFFFAOYSA-NSynonyms
3(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)phenylthiophene2carboxylate
C1C2C1C3C=CC2C4C3C(=O)N(C4=O)C5=CC(=CC=C5)OC(=O)C6=CC=CS6
InChI=1SC22H17NO4Sc242018136714(161015(13)16)19(18)21(25)23(20)1131412(911)2722(26)175282817h1913161819H10H2
MFCD03274464
ZINC000239433355
ZINC000239433358
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