Vitas-M small molecule compound
(2E)-2-cyano-3-(3-methoxy-4-{2-[(4-methylphenyl)amino]-2-oxoethoxy}phenyl)-N-(4-methylphenyl)prop-2-enamide
Catalog ID
STK090391
SMILES N#C/C(=C\c1ccc(c(c1)OC)OCC(=O)Nc1ccc(cc1)C)/C(=O)Nc1ccc(cc1)C
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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 C27H25N3O4 MW 455.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O4/c1-18-4-9-22(10-5-18)29-26(31)17-34-24-13-8-20(15-25(24)33-3)14-21(16-28)27(32)30-23-11-6-19(2)7-12-23/h4-15H,17H2,1-3H3,(H,29,31)(H,30,32)/b21-14+InChIKey
KCMYVEADVDVJCT-KGENOOAVSA-NSynonyms
(2E)2CYANO3(3METHOXY4(2((4METHYLPHENYL)AMINO)2OXOETHOXY)PHENYL)N(4METHYLPHENYL)PROP2ENAMIDE
(E)2CYANO3(3METHOXY4(2(4METHYLANILINO)2OXOETHOXY)PHENYL)N(4METHYLPHENYL)PROP2ENAMIDE
CC1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)C=C(C#N)C(=O)NC3=CC=C(C=C3)C)OC
InChI=1SC27H25N3O4c1184922(10518)2926(31)17342413820(1525(24)333)1421(1628)27(32)302311619(2)71223h415H17H213H3(H2931)(H3032)b2114+
MFCD05485251
N#CC(=Cc1ccc(c(c1)OC)OCC(=O)Nc1ccc(cc1)C)C(=O)Nc1ccc(cc1)C
STK090391
ZINC000009234486
ZINC09234486
ZINC9234486
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