Vitas-M small molecule compound
5-(2-chloro-6-fluorobenzyl)-4-[4-(propan-2-yl)phenyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK444059
SMILES CC(c1ccc(cc1)n1c(S)nnc1Cc1c(F)cccc1Cl)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 C18H17ClFN3S MW 361.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClFN3S/c1-11(2)12-6-8-13(9-7-12)23-17(21-22-18(23)24)10-14-15(19)4-3-5-16(14)20/h3-9,11H,10H2,1-2H3,(H,22,24)InChIKey
WQQGTUVSOBJTRI-UHFFFAOYSA-NSynonyms
3((2chloro6fluorophenyl)methyl)4(4propan2ylphenyl)1H124triazole5thione
5((2CHLORO6FLUOROPHENYL)METHYL)4(4(METHYLETHYL)PHENYL)124TRIAZOLE3THIOL
5(2chloro6fluorobenzyl)4(4(propan2yl)phenyl)4H124triazole3thiol
CC(C)C1=CC=C(C=C1)N2C(=NNC2=S)CC3=C(C=CC=C3Cl)F
InChI=1SC18H17ClFN3Sc111(2)126813(9712)2317(212218(23)24)101415(19)43516(14)20h3911H10H212H3(H2224)
MFCD04055254
ZINC000006387304
ZINC06387304
ZINC6387304
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