Vitas-M small molecule compound
4-(3-bromo-4,5-dimethoxyphenyl)-6,8,9-trichloro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Catalog ID
STK112078
SMILES COc1c(Br)cc(cc1OC)C1Nc2c(Cl)cc(c(c2C2C1CC=C2)Cl)Cl
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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 C20H17BrCl3NO2 MW 489.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17BrCl3NO2/c1-26-15-7-9(6-12(21)20(15)27-2)18-11-5-3-4-10(11)16-17(24)13(22)8-14(23)19(16)25-18/h3-4,6-8,10-11,18,25H,5H2,1-2H3InChIKey
HSJLBXMGTFVQKV-UHFFFAOYSA-NSynonyms
4(3BROMO45DIMETHOXYPHENYL)689TRICHLORO3A459BTETRAHYDRO3HCYCLOPENTA(C)QUINOLINE
COC1=C(C(=CC(=C1)C2C3CC=CC3C4=C(N2)C(=CC(=C4Cl)Cl)Cl)Br)OC
InChI=1SC20H17BrCl3NO2c1261579(612(21)20(15)272)181153410(11)1617(24)13(22)814(23)19(16)2518h346810111825H5H212H3
MFCD04127135
ZINC000009763399
ZINC000059267078
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