Vitas-M small molecule compound
5-{4-[(2-bromophenoxy)methyl]phenyl}-4-(2-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK307195
SMILES CCOc1ccccc1n1c(S)nnc1c1ccc(cc1)COc1ccccc1Br
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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 C23H20BrN3O2S MW 482.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20BrN3O2S/c1-2-28-21-10-6-4-8-19(21)27-22(25-26-23(27)30)17-13-11-16(12-14-17)15-29-20-9-5-3-7-18(20)24/h3-14H,2,15H2,1H3,(H,26,30)InChIKey
LCPPNSMPOKGNPQ-UHFFFAOYSA-NSynonyms
828290-32-03(4((2BROMOPHENOXY)METHYL)PHENYL)4(2ETHOXYPHENYL)1H124TRIAZOLE5THIONE
5(4((2bromophenoxy)methyl)phenyl)4(2ethoxyphenyl)4H124triazole3thiol
828290320
CCOC1=CC=CC=C1N2C(=NNC2=S)C3=CC=C(C=C3)COC4=CC=CC=C4Br
InChI=1SC23H20BrN3O2Sc1228211064819(21)2722(252623(27)30)17131116(121417)152920953718(20)24h314H215H21H3(H2630)
MFCD04052717
ZINC000002793167
ZINC2793167
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