Vitas-M small molecule compound

5,5-dimethyl-2-({[2-(2-methyl-1H-indol-3-yl)ethyl]amino}methylidene)cyclohexane-1,3-dione

Catalog ID
STK680166
SMILES O=C1CC(C)(C)CC(=O)C1=CNCCc1c(C)[nH]c2c1cccc2

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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 C20H24N2O2 MW 324.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O2/c1-13-14(15-6-4-5-7-17(15)22-13)8-9-21-12-16-18(23)10-20(2,3)11-19(16)24/h4-7,12,21-22H,8-11H2,1-3H3
InChIKey
IAPBEOSBIUBSNM-UHFFFAOYSA-N
Synonyms

55dimethyl2(((2(2methyl1Hindol3yl)ethyl)amino)methylidene)cyclohexane13dione
55DIMETHYL2((2(2METHYL1HINDOL3YL)ETHYLAMINO)METHYLIDENE)CYCLOHEXANE13DIONE
CC1=C(C2=CC=CC=C2N1)CCNC=C3C(=O)CC(CC3=O)(C)C
InChI=1SC20H24N2O2c11314(15645717(15)2213)8921121618(23)1020(23)1119(16)24h47122122H811H213H3
MFCD03766765
O=C1CC(C)(C)CC(=O)C1=CNCCc1c(C)(nH)c2c1cccc2
ZINC000100130323
ZINC100130323

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Available files

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