Vitas-M small molecule compound
(5-bromofuran-2-yl)[2-methyl-3-(3-methylphenyl)-4-thioxo-3,4-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-5(6H)-yl]methanone
Catalog ID
STL192574
SMILES Cc1cccc(c1)N1C(=S)N(C(=O)c2ccc(o2)Br)C2CC1(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 C23H19BrN2O3S MW 483.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19BrN2O3S/c1-14-6-5-7-15(12-14)26-22(30)25(21(27)19-10-11-20(24)28-19)17-13-23(26,2)29-18-9-4-3-8-16(17)18/h3-12,17H,13H2,1-2H3InChIKey
RFDFRJRIWFSJQJ-UHFFFAOYSA-NSynonyms
(5bromofuran2yl)(2methyl3(3methylphenyl)4thioxo34dihydro2H26methano135benzoxadiazocin5(6H)yl)methanone
CC1=CC(=CC=C1)N2C(=S)N(C3CC2(OC4=CC=CC=C34)C)C(=O)C5=CC=C(O5)Br
InChI=1SC23H19BrN2O3Sc11465715(1214)2622(30)25(21(27)19101120(24)2819)171323(262)2918943816(17)18h31217H13H212H3
MFCD14741453
ZINC000100033640
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Check stock on Vitas-MAvailable files
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