Vitas-M small molecule compound
4-[(1E)-2-cyano-3-{[2-(methoxycarbonyl)phenyl]amino}-3-oxoprop-1-en-1-yl]phenyl naphthalene-1-carboxylate
Catalog ID
STK522832
SMILES N#C/C(=C\c1ccc(cc1)OC(=O)c1cccc2c1cccc2)/C(=O)Nc1ccccc1C(=O)OC
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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 C29H20N2O5 MW 476.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H20N2O5/c1-35-28(33)25-10-4-5-12-26(25)31-27(32)21(18-30)17-19-13-15-22(16-14-19)36-29(34)24-11-6-8-20-7-2-3-9-23(20)24/h2-17H,1H3,(H,31,32)/b21-17+InChIKey
YTAXLMYQAOXEEP-HEHNFIMWSA-NSynonyms
(4((E)2CYANO3(2METHOXYCARBONYLANILINO)3OXOPROP1ENYL)PHENYL)NAPHTHALENE1CARBOXYLATE
4((1E)2cyano3((2(methoxycarbonyl)phenyl)amino)3oxoprop1en1yl)phenylnaphthalene1carboxylate
COC(=O)C1=CC=CC=C1NC(=O)C(=CC2=CC=C(C=C2)OC(=O)C3=CC=CC4=CC=CC=C43)C#N
InChI=1SC29H20N2O5c13528(33)2510451226(25)3127(32)21(1830)1719131522(161419)3629(34)24116820723923(20)24h217H1H3(H3132)b2117+
MFCD03154984
N#CC(=Cc1ccc(cc1)OC(=O)c1cccc2c1cccc2)C(=O)Nc1ccccc1C(=O)OC
ZINC000001439561
ZINC01439561
ZINC1439561
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