Vitas-M small molecule compound
8-bromo-3-(5-chloro-2-methylphenyl)-10-methoxy-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Catalog ID
STL124871
SMILES COc1cc(Br)cc2c1OC1(C)CC2NC(=O)N1c1cc(Cl)ccc1C
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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 C19H18BrClN2O3 MW 437.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18BrClN2O3/c1-10-4-5-12(21)8-15(10)23-18(24)22-14-9-19(23,2)26-17-13(14)6-11(20)7-16(17)25-3/h4-8,14H,9H2,1-3H3,(H,22,24)InChIKey
QSJUWAQWWNGLSC-UHFFFAOYSA-NSynonyms
8bromo3(5chloro2methylphenyl)10methoxy2methyl2356tetrahydro4H26methano135benzoxadiazocin4one
CC1=C(C=C(C=C1)Cl)N2C(=O)NC3CC2(OC4=C(C=C(C=C34)Br)OC)C
InChI=1SC19H18BrClN2O3c1104512(21)815(10)2318(24)2214919(232)261713(14)611(20)716(17)253h4814H9H213H3(H2224)
MFCD20736225
ZINC000102907977
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