Vitas-M small molecule compound
2-({4-ethyl-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-phenylethanone
Catalog ID
STK728112
SMILES CCn1c(COc2ccc(cc2)C)nnc1SCC(=O)c1ccccc1
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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 C20H21N3O2S MW 367.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O2S/c1-3-23-19(13-25-17-11-9-15(2)10-12-17)21-22-20(23)26-14-18(24)16-7-5-4-6-8-16/h4-12H,3,13-14H2,1-2H3InChIKey
RJRQTTROFMYOBS-UHFFFAOYSA-NSynonyms
849017-81-82((4ETHYL5((4METHYLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
2((4ethyl5((4methylphenoxy)methyl)4H124triazol3yl)sulfanyl)1phenylethanone
2((4ethyl5((ptolyloxy)methyl)4H124triazol3yl)thio)1phenylethanone
849017818
CCN1C(=NN=C1SCC(=O)C2=CC=CC=C2)COC3=CC=C(C=C3)C
InChI=1SC20H21N3O2Sc132319(13251711915(2)101217)212220(23)261418(24)167546816h412H31314H212H3
MFCD05680854
ZINC000002452290
ZINC02452290
ZINC2452290
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