Vitas-M small molecule compound
8-bromo-10-methoxy-3-(2-methoxy-5-methylphenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Catalog ID
STL192639
SMILES COc1cc(Br)cc2c1OC1(C)CC2NC(=O)N1c1cc(C)ccc1OC
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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 C20H21BrN2O4 MW 433.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21BrN2O4/c1-11-5-6-16(25-3)15(7-11)23-19(24)22-14-10-20(23,2)27-18-13(14)8-12(21)9-17(18)26-4/h5-9,14H,10H2,1-4H3,(H,22,24)InChIKey
USOLELLCBQHGHM-UHFFFAOYSA-NSynonyms
8bromo10methoxy3(2methoxy5methylphenyl)2methyl2356tetrahydro4H26methano135benzoxadiazocin4one
CC1=CC(=C(C=C1)OC)N2C(=O)NC3CC2(OC4=C(C=C(C=C34)Br)OC)C
InChI=1SC20H21BrN2O4c1115616(253)15(711)2319(24)22141020(232)271813(14)812(21)917(18)264h5914H10H214H3(H2224)
MFCD22390780
ZINC000101353050
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