Vitas-M small molecule compound
methyl ({5-[1-(3,5-dimethylphenoxy)ethyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Catalog ID
STK470245
SMILES COC(=O)CSc1nnc(n1C)C(Oc1cc(C)cc(c1)C)C
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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 C16H21N3O3S MW 335.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N3O3S/c1-10-6-11(2)8-13(7-10)22-12(3)15-17-18-16(19(15)4)23-9-14(20)21-5/h6-8,12H,9H2,1-5H3InChIKey
GOCZEVGVLCTMKJ-UHFFFAOYSA-NSynonyms
CC1=CC(=CC(=C1)OC(C)C2=NN=C(N2C)SCC(=O)OC)C
InChI=1SC16H21N3O3Sc110611(2)813(710)2212(3)15171816(19(15)4)23914(20)215h6812H9H215H3
methyl((5(1(35dimethylphenoxy)ethyl)4methyl4H124triazol3yl)sulfanyl)acetate
methyl2((5(1(35dimethylphenoxy)ethyl)4methyl124triazol3yl)sulfanyl)acetate
METHYL2(5((35DIMETHYLPHENOXY)ETHYL)4METHYL124TRIAZOL3YLTHIO)ACETATE
MFCD06105074
ZINC000017070643
ZINC000017070644
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