Vitas-M small molecule compound

1-(2,3-dihydro-1H-indol-1-yl)-2-{[5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone

Catalog ID
STK261214
SMILES COc1ccc(cc1)c1nnc(n1C)SCC(=O)N1CCc2c1cccc2

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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 C20H20N4O2S MW 380.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O2S/c1-23-19(15-7-9-16(26-2)10-8-15)21-22-20(23)27-13-18(25)24-12-11-14-5-3-4-6-17(14)24/h3-10H,11-13H2,1-2H3
InChIKey
JXQMLXNYIMCJDF-UHFFFAOYSA-N
Synonyms

1(23DIHYDRO1HINDOL1YL)2((5(4METHOXYPHENYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ETHANONE
1(23dihydroindol1yl)2((5(4methoxyphenyl)4methyl124triazol3yl)sulfanyl)ethanone
CN1C(=NN=C1SCC(=O)N2CCC3=CC=CC=C32)C4=CC=C(C=C4)OC
InChI=1SC20H20N4O2Sc12319(157916(262)10815)212220(23)271318(25)24121114534617(14)24h310H1113H212H3
MFCD02750028
ZINC000000880974
ZINC00880974
ZINC880974

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Available files

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