Vitas-M small molecule compound
1-({3-methyl-2-[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]-1-benzofuran-5-yl}sulfonyl)azepane
Catalog ID
STL141849
SMILES Cc1c(oc2c1cc(cc2)S(=O)(=O)N1CCCCCC1)c1onc(n1)c1ccccn1
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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 C22H22N4O4S MW 438.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O4S/c1-15-17-14-16(31(27,28)26-12-6-2-3-7-13-26)9-10-19(17)29-20(15)22-24-21(25-30-22)18-8-4-5-11-23-18/h4-5,8-11,14H,2-3,6-7,12-13H2,1H3InChIKey
XEDWNHZZRGJCBS-UHFFFAOYSA-NSynonyms
1351799-20-61((3methyl2(3(pyridin2yl)124oxadiazol5yl)1benzofuran5yl)sulfonyl)azepane
1((3METHYL2(3PYRIDIN2YL124OXADIAZOL5YL)1BENZOFURAN5YL)SULFONYL)AZEPANE
1351799206
5(5(azepan1ylsulfonyl)3methyl1benzofuran2yl)3pyridin2yl124oxadiazole
CC1=C(OC2=C1C=C(C=C2)S(=O)(=O)N3CCCCCC3)C4=NC(=NO4)C5=CC=CC=N5
InChI=1SC22H22N4O4Sc115171416(31(2728)261262371326)91019(17)2920(15)222421(253022)18845112318h4581114H23671213H21H3
MFCD20734680
ZINC000064948536
ZINC64948536
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