Vitas-M small molecule compound

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

Catalog ID
STK697179
SMILES CCn1c(SCC(=O)c2ccc(cc2)c2ccccc2)nnc1c1ccc(cc1)C(C)(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 C28H29N3OS MW 455.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3OS/c1-5-31-26(23-15-17-24(18-16-23)28(2,3)4)29-30-27(31)33-19-25(32)22-13-11-21(12-14-22)20-9-7-6-8-10-20/h6-18H,5,19H2,1-4H3
InChIKey
RRAHKZVDDPVVDA-UHFFFAOYSA-N
Synonyms
861629-23-4
1((11biphenyl)4yl)2((5(4(tertbutyl)phenyl)4ethyl4H124triazol3yl)thio)ethanone
1(biphenyl4yl)2((5(4tertbutylphenyl)4ethyl4H124triazol3yl)sulfanyl)ethanone
2((5(4TERTBUTYLPHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)1(4PHENYLPHENYL)ETHANONE
2((5(4TERTBUTYLPHENYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)1(4PHENYLPHENYL)ETHAN1ONE
2(5(4(TERTBUTYL)PHENYL)4ETHYL(124TRIAZOL3YLTHIO))1(4PHENYLPHENYL)ETHAN1ONE
861629234
CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC28H29N3OSc153126(23151724(181623)28(23)4)293027(31)331925(32)22131121(121422)2097681020h618H519H214H3
MFCD05684795
ZINC000009478261
ZINC09478261
ZINC9478261

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Available files

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