Vitas-M small molecule compound
5-[(benzylsulfanyl)methyl]-4-(3-chloro-4-fluorophenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK440465
SMILES Fc1ccc(cc1Cl)n1c(CSCc2ccccc2)nnc1S
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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 C16H13ClFN3S2 MW 365.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClFN3S2/c17-13-8-12(6-7-14(13)18)21-15(19-20-16(21)22)10-23-9-11-4-2-1-3-5-11/h1-8H,9-10H2,(H,20,22)InChIKey
WTCFTTHAGRJLLM-UHFFFAOYSA-NSynonyms
3(BENZYLSULFANYLMETHYL)4(3CHLORO4FLUOROPHENYL)1H124TRIAZOLE5THIONE
4(3CHLORO4FLUOROPHENYL)5((PHENYLMETHYLTHIO)METHYL)124TRIAZOLE3THIOL
5((benzylsulfanyl)methyl)4(3chloro4fluorophenyl)4H124triazole3thiol
C1=CC=C(C=C1)CSCC2=NNC(=S)N2C3=CC(=C(C=C3)F)Cl
InChI=1SC16H13ClFN3S2c1713812(6714(13)18)2115(192016(21)22)10239114213511h18H910H2(H2022)
MFCD03946253
ZINC000017075172
ZINC17075172
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