Vitas-M small molecule compound
3-{(1E)-2-cyano-3-[(3,5-dichlorophenyl)amino]-3-oxoprop-1-en-1-yl}phenyl naphthalene-1-carboxylate
Catalog ID
STK522740
SMILES N#C/C(=C\c1cccc(c1)OC(=O)c1cccc2c1cccc2)/C(=O)Nc1cc(Cl)cc(c1)Cl
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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 C27H16Cl2N2O3 MW 487.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H16Cl2N2O3/c28-20-13-21(29)15-22(14-20)31-26(32)19(16-30)11-17-5-3-8-23(12-17)34-27(33)25-10-4-7-18-6-1-2-9-24(18)25/h1-15H,(H,31,32)/b19-11+InChIKey
TXQMJSPVMQHMHO-YBFXNURJSA-NSynonyms
(3((E)2CYANO3(35DICHLOROANILINO)3OXOPROP1ENYL)PHENYL)NAPHTHALENE1CARBOXYLATE
3((1E)2cyano3((35dichlorophenyl)amino)3oxoprop1en1yl)phenylnaphthalene1carboxylate
C1=CC=C2C(=C1)C=CC=C2C(=O)OC3=CC=CC(=C3)C=C(C#N)C(=O)NC4=CC(=CC(=C4)Cl)Cl
InChI=1SC27H16Cl2N2O3c28201321(29)1522(1420)3126(32)19(1630)111753823(1217)3427(33)25104718612924(18)25h115H(H3132)b1911+
MFCD03155124
N#CC(=Cc1cccc(c1)OC(=O)c1cccc2c1cccc2)C(=O)Nc1cc(Cl)cc(c1)Cl
ZINC000003232176
ZINC03232176
ZINC3232176
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