Vitas-M small molecule compound
2-methoxy-N-(4-{[(5S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]sulfonyl}phenyl)benzamide
Catalog ID
STL527617
SMILES COc1ccccc1C(=O)Nc1ccc(cc1)S(=O)(=O)N1C[C@H]2CC(C1)c1n(C2)c(=O)ccc1
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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 C25H25N3O5S MW 479.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O5S/c1-33-23-7-3-2-5-21(23)25(30)26-19-9-11-20(12-10-19)34(31,32)27-14-17-13-18(16-27)22-6-4-8-24(29)28(22)15-17/h2-12,17-18H,13-16H2,1H3,(H,26,30)/t17-,18?/m0/s1InChIKey
XWGRQIXELKGBIL-ZENAZSQFSA-NSynonyms
2methoxyN(4(((1R5R)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)sulfonyl)phenyl)benzamide
2methoxyN(4(((5S)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)sulfonyl)phenyl)benzamide
COc1ccccc1C(=O)Nc1ccc(cc1)S(=O)(=O)N1C(C@H)2CC(C1)c1n(C2)c(=O)ccc1
InChI=1SC25H25N3O5Sc13323732521(23)25(30)261991120(121019)34(3132)2714171318(1627)2264824(29)28(22)1517h2121718H1316H21H3(H2630)t1718?m0s1
MFCD06763879
ZINC000002137544
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