Vitas-M small molecule compound
(2E)-3-[(4-ethoxyphenyl)amino]-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)prop-2-en-1-one
Catalog ID
STK306871
SMILES CCOc1ccc(cc1)N/C=C/C(=O)C12CC3CC(C2)CC(C1)C3
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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 C21H27NO2 MW 325.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27NO2/c1-2-24-19-5-3-18(4-6-19)22-8-7-20(23)21-12-15-9-16(13-21)11-17(10-15)14-21/h3-8,15-17,22H,2,9-14H2,1H3/b8-7+InChIKey
XAUGFFWAIKXCPP-BQYQJAHWSA-NSynonyms
678190-52-8(2E)1ADAMANTANYL3((4ETHOXYPHENYL)AMINO)PROP2EN1ONE
(2E)3((4ethoxyphenyl)amino)1(tricyclo(3311~37~)dec1yl)prop2en1one
(E)1(1ADAMANTYL)3(4ETHOXYANILINO)PROP2EN1ONE
678190528
CCOC1=CC=C(C=C1)NC=CC(=O)C23CC4CC(C2)CC(C4)C3
CCOc1ccc(cc1)NC=CC(=O)C12CC3CC(C2)CC(C1)C3
InChI=1SC21H27NO2c1224195318(4619)228720(23)211215916(1321)1117(1015)1421h38151722H2914H21H3b87+
MFCD04051127
ZINC000006393557
ZINC06393557
ZINC6393557
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