Vitas-M small molecule compound
3-[(2,6-dimethylphenoxy)methyl]-5-{[2-(2-methoxyphenoxy)ethyl]sulfanyl}-4-methyl-4H-1,2,4-triazole
Catalog ID
STK230606
SMILES COc1ccccc1OCCSc1nnc(n1C)COc1c(C)cccc1C
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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 C21H25N3O3S MW 399.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O3S/c1-15-8-7-9-16(2)20(15)27-14-19-22-23-21(24(19)3)28-13-12-26-18-11-6-5-10-17(18)25-4/h5-11H,12-14H2,1-4H3InChIKey
VOMJQJBWTIWTBA-UHFFFAOYSA-NSynonyms
3((26DIMETHYLPHENOXY)METHYL)5((2(2METHOXYPHENOXY)ETHYL)SULFANYL)4METHYL4H124TRIAZOLE
3((26DIMETHYLPHENOXY)METHYL)5(2(2METHOXYPHENOXY)ETHYLSULFANYL)4METHYL124TRIAZOLE
CC1=C(C(=CC=C1)C)OCC2=NN=C(N2C)SCCOC3=CC=CC=C3OC
InChI=1SC21H25N3O3Sc11587916(2)20(15)271419222321(24(19)3)281312261811651017(18)254h511H1214H214H3
MFCD07790420
ZINC000004736053
ZINC04736053
ZINC4736053
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