Vitas-M small molecule compound
2-amino-7-hydroxy-4-{3-methoxy-4-[(4-methylbenzyl)oxy]phenyl}-4H-chromene-3-carbonitrile
Catalog ID
STL379808
SMILES N#CC1=C(N)Oc2c(C1c1ccc(c(c1)OC)OCc1ccc(cc1)C)ccc(c2)O
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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 C25H22N2O4 MW 414.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O4/c1-15-3-5-16(6-4-15)14-30-21-10-7-17(11-23(21)29-2)24-19-9-8-18(28)12-22(19)31-25(27)20(24)13-26/h3-12,24,28H,14,27H2,1-2H3InChIKey
KJOQDGLMNALKCX-UHFFFAOYSA-NSynonyms
2amino7hydroxy4(3methoxy4((4methylbenzyl)oxy)phenyl)4Hchromene3carbonitrile
2AMINO7HYDROXY4(3METHOXY4((4METHYLPHENYL)METHOXY)PHENYL)4HCHROMENE3CARBONITRILE
CC1=CC=C(C=C1)COC2=C(C=C(C=C2)C3C4=C(C=C(C=C4)O)OC(=C3C#N)N)OC
InChI=1SC25H22N2O4c1153516(6415)14302110717(1123(21)292)24199818(28)1222(19)3125(27)20(24)1326h3122428H1427H212H3
MFCD04087041
ZINC000000804773
ZINC000000804775
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