Vitas-M small molecule compound
2-amino-4-{4-[(2-cyanobenzyl)oxy]-3-ethoxyphenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STL379696
SMILES CCOc1cc(ccc1OCc1ccccc1C#N)C1C(=C(N)OC2=C1C(=O)CCC2)C#N
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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 C26H23N3O4 MW 441.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O4/c1-2-31-23-12-16(10-11-21(23)32-15-18-7-4-3-6-17(18)13-27)24-19(14-28)26(29)33-22-9-5-8-20(30)25(22)24/h3-4,6-7,10-12,24H,2,5,8-9,15,29H2,1H3InChIKey
ZFQOSQMUOWCYPY-UHFFFAOYSA-NSynonyms
2amino4(4((2cyanobenzyl)oxy)3ethoxyphenyl)5oxo5678tetrahydro4Hchromene3carbonitrile
2amino4(4((2cyanophenyl)methoxy)3ethoxyphenyl)5oxo4678tetrahydrochromene3carbonitrile
2AMINO4(4((2CYANOPHENYL)METHOXY)3ETHOXYPHENYL)5OXO4H678TRIHYDROCHROMENE3CARBONITRILE
CCOC1=C(C=CC(=C1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)OCC4=CC=CC=C4C#N
InChI=1SC26H23N3O4c1231231216(101121(23)321518743617(18)1327)2419(1428)26(29)332295820(30)25(22)24h3467101224H25891529H21H3
MFCD05239487
ZINC000000800545
ZINC000000800546
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