Vitas-M small molecule compound

1-(2,3-dihydro-1H-indol-1-yl)-4-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)butan-1-one

Catalog ID
STK785249
SMILES O=C(N1CCc2c1cccc2)CCCn1nc(c(c1C)I)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 C17H20IN3O MW 409.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20IN3O/c1-12-17(18)13(2)21(19-12)10-5-8-16(22)20-11-9-14-6-3-4-7-15(14)20/h3-4,6-7H,5,8-11H2,1-2H3
InChIKey
YBLGSMPKPYANFS-UHFFFAOYSA-N
Synonyms

1(23dihydro1Hindol1yl)4(4iodo35dimethyl1Hpyrazol1yl)butan1one
1(23DIHYDROINDOL1YL)4(4IODO35DIMETHYLPYRAZOL1YL)BUTAN1ONE
1INDOLINYL4(4IODO35DIMETHYLPYRAZOLYL)BUTAN1ONE
CC1=C(C(=NN1CCCC(=O)N2CCC3=CC=CC=C32)C)I
InChI=1SC17H20IN3Oc11217(18)13(2)21(1912)105816(22)2011914634715(14)20h3467H5811H212H3
MFCD07657922
ZINC000004776585
ZINC04776585
ZINC4776585

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Available files

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