Vitas-M small molecule compound

3-[(3,4-dichlorobenzyl)sulfanyl]-4-ethyl-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazole

Catalog ID
STL061937
SMILES CCn1c(COc2ccc(cc2)C)nnc1SCc1ccc(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 C19H19Cl2N3OS MW 408.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19Cl2N3OS/c1-3-24-18(11-25-15-7-4-13(2)5-8-15)22-23-19(24)26-12-14-6-9-16(20)17(21)10-14/h4-10H,3,11-12H2,1-2H3
InChIKey
XQATWBUTDUZOFT-UHFFFAOYSA-N
Synonyms
862117-46-2
1((5((34DICHLOROPHENYL)METHYLTHIO)4ETHYL(124TRIAZOL3YL))METHOXY)4METHYLBENZENE
3(((34DICHLOROPHENYL)METHYL)SULFANYL)4ETHYL5(4METHYLPHENOXYMETHYL)4H124TRIAZOLE
3((34dichlorobenzyl)sulfanyl)4ethyl5((4methylphenoxy)methyl)4H124triazole
3((34dichlorobenzyl)thio)4ethyl5((ptolyloxy)methyl)4H124triazole
3((34DICHLOROPHENYL)METHYLSULFANYL)4ETHYL5((4METHYLPHENOXY)METHYL)124TRIAZOLE
862117462
CCN1C(=NN=C1SCC2=CC(=C(C=C2)Cl)Cl)COC3=CC=C(C=C3)C
InChI=1SC19H19Cl2N3OSc132418(1125157413(2)5815)222319(24)2612146916(20)17(21)1014h410H31112H212H3
MFCD05687191
ZINC000005500599
ZINC05500599
ZINC5500599

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Available files

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