Vitas-M small molecule compound

1-(biphenyl-4-yl)-2-{[4-ethyl-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone

Catalog ID
STL026133
SMILES COc1ccccc1c1nnc(n1CC)SCC(=O)c1ccc(cc1)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 C25H23N3O2S MW 429.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O2S/c1-3-28-24(21-11-7-8-12-23(21)30-2)26-27-25(28)31-17-22(29)20-15-13-19(14-16-20)18-9-5-4-6-10-18/h4-16H,3,17H2,1-2H3
InChIKey
XBYKTIPNBTVMNP-UHFFFAOYSA-N
Synonyms
849000-88-0
1((11biphenyl)4yl)2((4ethyl5(2methoxyphenyl)4H124triazol3yl)thio)ethanone
1(biphenyl4yl)2((4ethyl5(2methoxyphenyl)4H124triazol3yl)sulfanyl)ethanone
2((4ETHYL5(2METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)1(4PHENYLPHENYL)ETHANONE
2((4ETHYL5(2METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)1(4PHENYLPHENYL)ETHAN1ONE
2(4ETHYL5(2METHOXYPHENYL)(124TRIAZOL3YLTHIO))1(4PHENYLPHENYL)ETHAN1ONE
849000880
CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C4=CC=CC=C4OC
InChI=1SC25H23N3O2Sc132824(2111781223(21)302)262725(28)311722(29)20151319(141620)1895461018h416H317H212H3
MFCD05539501
ZINC000009234985
ZINC09234985
ZINC9234985

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Available files

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