Vitas-M small molecule compound
8-bromo-N-(4-chlorophenyl)-2-methyl-4-thioxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxamide
Catalog ID
STL141915
SMILES S=C1NC2c3cc(Br)ccc3OC(N1)(C2C(=O)Nc1ccc(cc1)Cl)C
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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 C18H15BrClN3O2S MW 452.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15BrClN3O2S/c1-18-14(16(24)21-11-5-3-10(20)4-6-11)15(22-17(26)23-18)12-8-9(19)2-7-13(12)25-18/h2-8,14-15H,1H3,(H,21,24)(H2,22,23,26)InChIKey
KFTBHYJPVZFBSF-UHFFFAOYSA-NSynonyms
1022746-25-31022746253
8bromoN(4chlorophenyl)2methyl4thioxo3456tetrahydro2H26methano135benzoxadiazocine11carboxamide
CC12C(C(C3=C(O1)C=CC(=C3)Br)NC(=S)N2)C(=O)NC4=CC=C(C=C4)Cl
InChI=1SC18H15BrClN3O2Sc11814(16(24)21115310(20)4611)15(2217(26)2318)1289(19)2713(12)2518h281415H1H3(H2124)(H2222326)
MFCD05032607
ZINC000002962775
ZINC000020641303
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