Vitas-M small molecule compound
2-[(3,4-diethoxyphenyl)acetyl]-3-(methylamino)-5-phenylcyclohex-2-en-1-one
Catalog ID
STK683141
SMILES CCOc1cc(ccc1OCC)CC(=O)C1=C(NC)CC(CC1=O)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 C25H29NO4 MW 407.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29NO4/c1-4-29-23-12-11-17(14-24(23)30-5-2)13-21(27)25-20(26-3)15-19(16-22(25)28)18-9-7-6-8-10-18/h6-12,14,19,26H,4-5,13,15-16H2,1-3H3InChIKey
PDSVKGBGSLZTIM-UHFFFAOYSA-NSynonyms
2((34diethoxyphenyl)acetyl)3(methylamino)5phenylcyclohex2en1one
2(2(34DIETHOXYPHENYL)ACETYL)3(METHYLAMINO)5PHENYLCYCLOHEX2EN1ONE
CCOC1=C(C=C(C=C1)CC(=O)C2=C(CC(CC2=O)C3=CC=CC=C3)NC)OCC
InChI=1SC25H29NO4c142923121117(1424(23)3052)1321(27)2520(263)1519(1622(25)28)1897681018h612141926H45131516H213H3
MFCD05256880
ZINC000100155612
ZINC000100155615
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