Vitas-M small molecule compound

(3E)-4-[(1,6-dimethyl-2-phenyl-1H-indol-5-yl)amino]pent-3-en-2-one

Catalog ID
STK685916
SMILES C/C(=C\C(=O)C)/Nc1cc2cc(n(c2cc1C)C)c1ccccc1

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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 C21H22N2O MW 318.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O/c1-14-10-20-18(12-19(14)22-15(2)11-16(3)24)13-21(23(20)4)17-8-6-5-7-9-17/h5-13,22H,1-4H3/b15-11+
InChIKey
UCWMUGJPCADSMT-RVDMUPIBSA-N
Synonyms
(3E)4((16dimethyl2phenyl1Hindol5yl)amino)pent3en2one
(E)4((16DIMETHYL2PHENYLINDOL5YL)AMINO)PENT3EN2ONE
3PENTEN2ONE4((16DIMETHYL2PHENYL1HINDOL5YL)AMINO)
CC(=CC(=O)C)Nc1cc2cc(n(c2cc1C)C)c1ccccc1
CC1=C(C=C2C=C(N(C2=C1)C)C3=CC=CC=C3)NC(=CC(=O)C)C
Registry IDs
MFCD06013763
ZINC000001432255
ZINC01432255
ZINC1432255

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Available files

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