Vitas-M small molecule compound
3-(3-bromophenyl)-5-{[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
Catalog ID
STK664310
SMILES Brc1cccc(c1)c1nnc(n1c1ccccc1)Sc1ccc(cc1[N+](=O)[O-])C(F)(F)F
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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 C21H12BrF3N4O2S MW 521.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12BrF3N4O2S/c22-15-6-4-5-13(11-15)19-26-27-20(28(19)16-7-2-1-3-8-16)32-18-10-9-14(21(23,24)25)12-17(18)29(30)31/h1-12HInChIKey
MNOXVDRGTYOIBX-UHFFFAOYSA-NSynonyms
3(3bromophenyl)5((2nitro4(trifluoromethyl)phenyl)sulfanyl)4phenyl4H124triazole
3(3BROMOPHENYL)5(2NITRO4(TRIFLUOROMETHYL)PHENYL)SULFANYL4PHENYL124TRIAZOLE
Brc1cccc(c1)c1nnc(n1c1ccccc1)Sc1ccc(cc1(N+)(=O)(O))C(F)(F)F
C1=CC=C(C=C1)N2C(=NN=C2SC3=C(C=C(C=C3)C(F)(F)F)(N+)(=O)(O))C4=CC(=CC=C4)Br
InChI=1SC21H12BrF3N4O2Sc221564513(1115)19262720(28(19)167213816)321810914(21(2324)25)1217(18)29(30)31h112H
MFCD01240152
ZINC000003663806
ZINC03663806
ZINC3663806
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