Vitas-M small molecule compound

1-(dimethylamino)-2,6,6-trimethyl-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one

Catalog ID
STK765466
SMILES O=C1CC(C)(C)Cc2c1c(CC(Cl)(Cl)Cl)c(n2N(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 C15H21Cl3N2O MW 351.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H21Cl3N2O/c1-9-10(6-15(16,17)18)13-11(20(9)19(4)5)7-14(2,3)8-12(13)21/h6-8H2,1-5H3
InChIKey
AHWSAEKQHLBDRP-UHFFFAOYSA-N
Synonyms

1(dimethylamino)266trimethyl3(222trichloroethyl)1567tetrahydro4Hindol4one
1(DIMETHYLAMINO)266TRIMETHYL3(222TRICHLOROETHYL)57DIHYDROINDOL4ONE
CC1=C(C2=C(N1N(C)C)CC(CC2=O)(C)C)CC(Cl)(Cl)Cl
InChI=1SC15H21Cl3N2Oc1910(615(1617)18)1311(20(9)19(4)5)714(23)812(13)21h68H215H3
MFCD02933721
ZINC000000719092
ZINC00719092
ZINC719092

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Available files

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