Vitas-M small molecule compound
(1S,5R)-3-{3-[1-(2-chlorobenzyl)-2-hydroxy-5-oxo-4,5-dihydro-1H-imidazol-4-yl]propanoyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL543271
SMILES O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)CCC1N=C(N(C1=O)Cc1ccccc1Cl)O
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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 C24H25ClN4O4 MW 468.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25ClN4O4/c25-18-5-2-1-4-16(18)14-29-23(32)19(26-24(29)33)8-9-21(30)27-11-15-10-17(13-27)20-6-3-7-22(31)28(20)12-15/h1-7,15,17,19H,8-14H2,(H,26,33)/t15-,17+,19?/m0/s1InChIKey
UGJPKECSBBDNQH-NADDXPSSSA-NSynonyms
(1S5R)3(3(1(2chlorobenzyl)2hydroxy5oxo45dihydro1Himidazol4yl)propanoyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
InChI=1SC24H25ClN4O4c2518521416(18)142923(32)19(2624(29)33)8921(30)2711151017(1327)2063722(31)28(20)1215h17151719H814H2(H2633)t1517+19?m0s1
ZINC000096222144
ZINC000252551746
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