Vitas-M small molecule compound
2-(3-bromophenyl)-5-{[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl}-1,3,4-oxadiazole
Catalog ID
STK733986
SMILES Brc1cccc(c1)c1nnc(o1)Sc1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]
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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 C15H6BrF3N4O5S MW 491.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H6BrF3N4O5S/c16-9-3-1-2-7(4-9)13-20-21-14(28-13)29-12-10(22(24)25)5-8(15(17,18)19)6-11(12)23(26)27/h1-6HInChIKey
OJMIJNJOZQHGNX-UHFFFAOYSA-NSynonyms
2(3bromophenyl)5((26dinitro4(trifluoromethyl)phenyl)sulfanyl)134oxadiazole
2(3BROMOPHENYL)5(26DINITRO4(TRIFLUOROMETHYL)PHENYL)SULFANYL134OXADIAZOLE
2(5(3BROMOPHENYL)(134OXADIAZOL2YLTHIO))13DINITRO5(TRIFLUOROMETHYL)BENZENE
Brc1cccc(c1)c1nnc(o1)Sc1c(cc(cc1(N+)(=O)(O))C(F)(F)F)(N+)(=O)(O)
C1=CC(=CC(=C1)Br)C2=NN=C(O2)SC3=C(C=C(C=C3(N+)(=O)(O))C(F)(F)F)(N+)(=O)(O)
InChI=1SC15H6BrF3N4O5Sc1693127(49)13202114(2813)291210(22(24)25)58(15(1718)19)611(12)23(26)27h16H
MFCD01442117
ZINC000003666894
ZINC03666894
ZINC3666894
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