Vitas-M small molecule compound
ethyl [3-cyano-4-(4-methoxyphenyl)-5-oxo-7-phenyl-5,6,7,8-tetrahydro-4H-chromen-2-yl]imidoformate
Catalog ID
STK164799
SMILES CCO/C=N/C1=C(C#N)C(C2=C(O1)CC(CC2=O)c1ccccc1)c1ccc(cc1)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 C26H24N2O4 MW 428.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O4/c1-3-31-16-28-26-21(15-27)24(18-9-11-20(30-2)12-10-18)25-22(29)13-19(14-23(25)32-26)17-7-5-4-6-8-17/h4-12,16,19,24H,3,13-14H2,1-2H3/b28-16+InChIKey
DXAFIBWRASZINF-LQKURTRISA-NSynonyms
2((1E)2ETHOXY1AZAVINYL)4(4METHOXYPHENYL)5OXO7PHENYL4H678TRIHYDROCHROMENE3CARBONITRILE
CCOC=NC1=C(C#N)C(C2=C(O1)CC(CC2=O)c1ccccc1)c1ccc(cc1)OC
CCOC=NC1=C(C(C2=C(O1)CC(CC2=O)C3=CC=CC=C3)C4=CC=C(C=C4)OC)C#N
ethyl(1E)N(3cyano4(4methoxyphenyl)5oxo7phenyl4678tetrahydrochromen2yl)methanimidate
ethyl(3cyano4(4methoxyphenyl)5oxo7phenyl5678tetrahydro4Hchromen2yl)imidoformate
InChI=1SC26H24N2O4c133116282621(1527)24(1891120(302)121018)2522(29)1319(1423(25)3226)177546817h412161924H31314H212H3b2816+
MFCD04222079
ZINC000002197106
ZINC000009846574
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