Vitas-M small molecule compound
4-{[4-(4-methoxyphenyl)-2-(thiophen-2-yl)-4H-chromen-3-yl]methyl}morpholin-4-ium
Catalog ID
STL439777
SMILES COc1ccc(cc1)C1C(=C(Oc2c1cccc2)c1cccs1)C[NH+]1CCOCC1
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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 C25H26NO3S MW 420.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO3S/c1-27-19-10-8-18(9-11-19)24-20-5-2-3-6-22(20)29-25(23-7-4-16-30-23)21(24)17-26-12-14-28-15-13-26/h2-11,16,24H,12-15,17H2,1H3/p+1InChIKey
URUPYTQUYKECIT-UHFFFAOYSA-OSynonyms
4((4(4methoxyphenyl)2(thiophen2yl)4Hchromen3yl)methyl)morpholin4ium
4((4(4METHOXYPHENYL)2THIOPHEN2YL4HCHROMEN3YL)METHYL)MORPHOLIN4IUM
COC1=CC=C(C=C1)C2C3=CC=CC=C3OC(=C2C(NH+)4CCOCC4)C5=CC=CS5
COc1ccc(cc1)C1C(=C(Oc2c1cccc2)c1cccs1)C(NH+)1CCOCC1
InChI=1SC25H25NO3Sc1271910818(91119)2420523622(20)2925(2374163023)21(24)1726121428151326h2111624H121517H21H3p+1
ZINC000025178230
ZINC000025178239
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