Vitas-M small molecule compound
4-benzyl-5-[1-(3,4-dichlorophenoxy)ethyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK448331
SMILES CC(c1nnc(n1Cc1ccccc1)S)Oc1ccc(c(c1)Cl)Cl
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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 C17H15Cl2N3OS MW 380.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15Cl2N3OS/c1-11(23-13-7-8-14(18)15(19)9-13)16-20-21-17(24)22(16)10-12-5-3-2-4-6-12/h2-9,11H,10H2,1H3,(H,21,24)InChIKey
ADNFLIIWVYGYCB-UHFFFAOYSA-NSynonyms
4benzyl3(1(34dichlorophenoxy)ethyl)1H124triazole5thione
4benzyl5(1(34dichlorophenoxy)ethyl)4H124triazole3thiol
5((34DICHLOROPHENOXY)ETHYL)4BENZYL124TRIAZOLE3THIOL
CC(C1=NNC(=S)N1CC2=CC=CC=C2)OC3=CC(=C(C=C3)Cl)Cl
InChI=1SC17H15Cl2N3OSc111(23137814(18)15(19)913)16202117(24)22(16)10125324612h2911H10H21H3(H2124)
MFCD04140267
ZINC000006851200
ZINC000006853065
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