Vitas-M small molecule compound

2-acetyl-3-{[2-(3,4-diethoxyphenyl)ethyl]amino}-5-phenylcyclohex-2-en-1-one

Catalog ID
STK682348
SMILES CCOc1cc(CCNC2=C(C(=O)C)C(=O)CC(C2)c2ccccc2)ccc1OCC

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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 C26H31NO4 MW 421.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31NO4/c1-4-30-24-12-11-19(15-25(24)31-5-2)13-14-27-22-16-21(20-9-7-6-8-10-20)17-23(29)26(22)18(3)28/h6-12,15,21,27H,4-5,13-14,16-17H2,1-3H3
InChIKey
QGFPTXYNBGCRJB-UHFFFAOYSA-N
Synonyms

(5S)2ACETYL3((2(34DIETHOXYPHENYL)ETHYL)AMINO)5PHENYLCYCLOHEX2EN1ONE
2acetyl3((2(34diethoxyphenyl)ethyl)amino)5phenylcyclohex2en1one
2ACETYL3(2(34DIETHOXYPHENYL)ETHYLAMINO)5PHENYLCYCLOHEX2EN1ONE
CCOC1=C(C=C(C=C1)CCNC2=C(C(=O)CC(C2)C3=CC=CC=C3)C(=O)C)OCC
InChI=1SC26H31NO4c143024121119(1525(24)3152)131427221621(2097681020)1723(29)26(22)18(3)28h612152127H4513141617H213H3
MFCD03855580
ZINC000100148030
ZINC000100148031

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Available files

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