Vitas-M small molecule compound
3-[(3,4-dichlorobenzyl)sulfanyl]-5-[(2,3-dimethylphenoxy)methyl]-4-ethyl-4H-1,2,4-triazole
Catalog ID
STL139260
SMILES CCn1c(nnc1COc1cccc(c1C)C)SCc1ccc(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 C20H21Cl2N3OS MW 422.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21Cl2N3OS/c1-4-25-19(11-26-18-7-5-6-13(2)14(18)3)23-24-20(25)27-12-15-8-9-16(21)17(22)10-15/h5-10H,4,11-12H2,1-3H3InChIKey
LBDWQEKPYOZIBF-UHFFFAOYSA-NSynonyms
3((34dichlorobenzyl)sulfanyl)5((23dimethylphenoxy)methyl)4ethyl4H124triazole
3((34DICHLOROPHENYL)METHYLSULFANYL)5((23DIMETHYLPHENOXY)METHYL)4ETHYL124TRIAZOLE
CCN1C(=NN=C1SCC2=CC(=C(C=C2)Cl)Cl)COC3=CC=CC(=C3C)C
InChI=1SC20H21Cl2N3OSc142519(11261875613(2)14(18)3)232420(25)2712158916(21)17(22)1015h510H41112H213H3
MFCD05110817
ZINC000002859247
ZINC02859247
ZINC2859247
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