Vitas-M small molecule compound
3-[5-(7-oxo-8,9-dihydro-7H-chromeno[5,6-c][1,2,5]thiadiazol-9-yl)furan-2-yl]benzoic acid
Catalog ID
STL411512
SMILES O=C1Oc2ccc3c(c2C(C1)c1ccc(o1)c1cccc(c1)C(=O)O)nsn3
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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 C20H12N2O5S MW 392.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12N2O5S/c23-17-9-12(18-16(27-17)5-4-13-19(18)22-28-21-13)15-7-6-14(26-15)10-2-1-3-11(8-10)20(24)25/h1-8,12H,9H2,(H,24,25)InChIKey
UPWSVGKEHSTVNM-UHFFFAOYSA-NSynonyms
1574302-13-81574302138
3(5(7oxo89dihydro7Hchromeno(56c)(125)thiadiazol9yl)furan2yl)benzoicacid
3(5(7oxo89dihydropyrano(23g)(213)benzothiadiazol9yl)furan2yl)benzoicacid
C1C(C2=C(C=CC3=NSN=C32)OC1=O)C4=CC=C(O4)C5=CC(=CC=C5)C(=O)O
InChI=1SC20H12N2O5Sc2317912(1816(2717)541319(18)22282113)157614(2615)1021311(810)20(24)25h1812H9H2(H2425)
MFCD28058727
ZINC000096231371
ZINC000096231372
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