Vitas-M small molecule compound
2-amino-4-{3-ethoxy-4-[(4-methylbenzyl)oxy]phenyl}-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile
Catalog ID
STK013200
SMILES CCOc1cc(ccc1OCc1ccc(cc1)C)C1C(=C(N)Oc2c1c(=O)oc(c2)C)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 C26H24N2O5 MW 444.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O5/c1-4-30-21-12-18(9-10-20(21)31-14-17-7-5-15(2)6-8-17)23-19(13-27)25(28)33-22-11-16(3)32-26(29)24(22)23/h5-12,23H,4,14,28H2,1-3H3InChIKey
VKUYEVNKXPVAKD-UHFFFAOYSA-NSynonyms
612054-29-22amino4(3ethoxy4((4methylbenzyl)oxy)phenyl)7methyl5oxo45dihydropyrano(43b)pyran3carbonitrile
2AMINO4(3ETHOXY4((4METHYLBENZYL)OXY)PHENYL)7METHYL5OXO4H5HPYRANO(43B)PYRAN3CARBONITRILE
2AMINO4(3ETHOXY4((4METHYLPHENYL)METHOXY)PHENYL)7METHYL5OXO4HPYRANO(32C)PYRAN3CARBONITRILE
612054292
CCOC1=C(C=CC(=C1)C2C(=C(OC3=C2C(=O)OC(=C3)C)N)C#N)OCC4=CC=C(C=C4)C
CCOc1cc(ccc1OCc1ccc(cc1)C)C1C(=C(N)Oc2c1c(=O)oc(c2)C)C#N
InChI=1SC26H24N2O5c1430211218(91020(21)3114177515(2)6817)2319(1327)25(28)33221116(3)3226(29)24(22)23h51223H41428H213H3
MFCD03664501
STK013200
ZINC000001455398
ZINC000001455399
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