Vitas-M small molecule compound

1-{[4-ethyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-3,3-dimethylbutan-2-one

Catalog ID
STL051400
SMILES CCn1c(nnc1SCC(=O)C(C)(C)C)COc1ccccc1

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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 C17H23N3O2S MW 333.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N3O2S/c1-5-20-15(11-22-13-9-7-6-8-10-13)18-19-16(20)23-12-14(21)17(2,3)4/h6-10H,5,11-12H2,1-4H3
InChIKey
SKZDAZGYRXDUAH-UHFFFAOYSA-N
Synonyms
849027-52-7
1((4ETHYL5(PHENOXYMETHYL)124TRIAZOL3YL)SULFANYL)33DIMETHYLBUTAN2ONE
1((4ethyl5(phenoxymethyl)4H124triazol3yl)sulfanyl)33dimethylbutan2one
1((4ethyl5(phenoxymethyl)4H124triazol3yl)thio)33dimethylbutan2one
1(4ETHYL5(PHENOXYMETHYL)(124TRIAZOL3YLTHIO))33DIMETHYLBUTAN2ONE
849027527
CCN1C(=NN=C1SCC(=O)C(C)(C)C)COC2=CC=CC=C2
InChI=1SC17H23N3O2Sc152015(11221397681013)181916(20)231214(21)17(23)4h610H51112H214H3
MFCD05681534
ZINC000002453645
ZINC02453645
ZINC2453645

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Available files

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