Vitas-M small molecule compound
(2E)-3-{3-methoxy-4-[(2-methylprop-2-en-1-yl)oxy]phenyl}-2-[(phenylcarbonyl)amino]prop-2-enoic acid
Catalog ID
STK393790
SMILES COc1cc(ccc1OCC(=C)C)/C=C(\C(=O)O)/NC(=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 C21H21NO5 MW 367.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO5/c1-14(2)13-27-18-10-9-15(12-19(18)26-3)11-17(21(24)25)22-20(23)16-7-5-4-6-8-16/h4-12H,1,13H2,2-3H3,(H,22,23)(H,24,25)/b17-11+InChIKey
HRVJZDILYYJOBT-GZTJUZNOSA-NSynonyms
(2E)3(3methoxy4((2methylprop2en1yl)oxy)phenyl)2((phenylcarbonyl)amino)prop2enoicacid
(2E)3(3METHOXY4(2METHYLPROP2ENYLOXY)PHENYL)2(PHENYLCARBONYLAMINO)PROP2ENOICACID
(E)2BENZAMIDO3(3METHOXY4(2METHYLPROP2ENOXY)PHENYL)PROP2ENOICACID
CC(=C)COC1=C(C=C(C=C1)C=C(C(=O)O)NC(=O)C2=CC=CC=C2)OC
COc1cc(ccc1OCC(=C)C)C=C(C(=O)O)NC(=O)c1ccccc1
InChI=1SC21H21NO5c114(2)13271810915(1219(18)263)1117(21(24)25)2220(23)167546816h412H113H223H3(H2223)(H2425)b1711+
MFCD03036960
ZINC000004171427
ZINC4171427
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