Vitas-M small molecule compound
N-[2-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-phenylacetamide
Catalog ID
STK690929
SMILES COc1cc(CCNC2=C(C(=O)CC(C2)(C)C)C(C(F)(F)F)(C(F)(F)F)NC(=O)Cc2ccccc2)ccc1OC
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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 C29H32F6N2O4 MW 586.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32F6N2O4/c1-26(2)16-20(36-13-12-19-10-11-22(40-3)23(14-19)41-4)25(21(38)17-26)27(28(30,31)32,29(33,34)35)37-24(39)15-18-8-6-5-7-9-18/h5-11,14,36H,12-13,15-17H2,1-4H3,(H,37,39)InChIKey
QKAHTLCNHOIBMN-UHFFFAOYSA-NSynonyms
CC1(CC(=C(C(=O)C1)C(C(F)(F)F)(C(F)(F)F)NC(=O)CC2=CC=CC=C2)NCCC3=CC(=C(C=C3)OC)OC)C
InChI=1SC29H32F6N2O4c126(2)1620(36131219101122(403)23(1419)414)25(21(38)1726)27(28(3031)3229(3334)35)3724(39)15188657918h5111436H12131517H214H3(H3739)
MFCD09064107
N(2(2((2(34dimethoxyphenyl)ethyl)amino)44dimethyl6oxocyclohex1en1yl)111333hexafluoropropan2yl)2phenylacetamide
N(2(2(2(34dimethoxyphenyl)ethylamino)44dimethyl6oxocyclohexen1yl)111333hexafluoropropan2yl)2phenylacetamide
ZINC000100229042
ZINC100229042
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