Vitas-M small molecule compound
2-methyl-3-phenyl-5-[(3,4,5-trimethoxyphenyl)carbonyl]-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Catalog ID
STL094507
SMILES COc1c(OC)cc(cc1OC)C(=O)N1C2CC(N(C1=O)c1ccccc1)(C)Oc1c2cccc1
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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 C27H26N2O6 MW 474.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O6/c1-27-16-20(19-12-8-9-13-21(19)35-27)28(26(31)29(27)18-10-6-5-7-11-18)25(30)17-14-22(32-2)24(34-4)23(15-17)33-3/h5-15,20H,16H2,1-4H3InChIKey
DLSIOWZWTAMSJO-UHFFFAOYSA-NSynonyms
2methyl3phenyl5((345trimethoxyphenyl)carbonyl)2356tetrahydro4H26methano135benzoxadiazocin4one
CC12CC(C3=CC=CC=C3O1)N(C(=O)N2C4=CC=CC=C4)C(=O)C5=CC(=C(C(=C5)OC)OC)OC
InChI=1SC27H26N2O6c1271620(1912891321(19)3527)28(26(31)29(27)18106571118)25(30)171422(322)24(344)23(1517)333h51520H16H214H3
MFCD14741464
ZINC000101354454
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