Vitas-M small molecule compound

2-fluoro-N-{2-[5-{[2-(1-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]ethyl}benzamide

Catalog ID
STK278759
SMILES C=CCn1c(CCNC(=O)c2ccccc2F)nnc1SCC(=O)c1cn(c2c1cccc2)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 C25H24FN5O2S MW 477.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24FN5O2S/c1-3-14-31-23(12-13-27-24(33)18-9-4-6-10-20(18)26)28-29-25(31)34-16-22(32)19-15-30(2)21-11-7-5-8-17(19)21/h3-11,15H,1,12-14,16H2,2H3,(H,27,33)
InChIKey
DDFQFUSMMURJNU-UHFFFAOYSA-N
Synonyms

2fluoroN(2(5((2(1methyl1Hindol3yl)2oxoethyl)sulfanyl)4(prop2en1yl)4H124triazol3yl)ethyl)benzamide
2fluoroN(2(5(2(1methylindol3yl)2oxoethyl)sulfanyl4prop2enyl124triazol3yl)ethyl)benzamide
CN1C=C(C2=CC=CC=C21)C(=O)CSC3=NN=C(N3CC=C)CCNC(=O)C4=CC=CC=C4F
InChI=1SC25H24FN5O2Sc13143123(12132724(33)189461020(18)26)282925(31)341622(32)191530(2)211175817(19)21h31115H1121416H22H3(H2733)
MFCD09269531
N(2(4ALLYL5(2(1METHYL1HINDOL3YL)2OXOETHYLSULFANYL)4H(124)TRIAZOL3YL)ETHYL)2FLUOROBENZAMIDE
ZINC000009095908
ZINC09095908
ZINC9095908

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.