Vitas-M small molecule compound
2-amino-4-(3-ethoxy-4-propoxyphenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK514876
SMILES CCCOc1ccc(cc1OCC)C1C(=C(N)OC2=C1C(=O)CC(C2)(C)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 C23H28N2O4 MW 396.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2O4/c1-5-9-28-17-8-7-14(10-18(17)27-6-2)20-15(13-24)22(25)29-19-12-23(3,4)11-16(26)21(19)20/h7-8,10,20H,5-6,9,11-12,25H2,1-4H3InChIKey
OHQRARSSWGWVIG-UHFFFAOYSA-NSynonyms
445265-93-02amino4(3ethoxy4propoxyphenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carbonitrile
2AMINO4(3ETHOXY4PROPOXYPHENYL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBONITRILE
445265930
CCCOC1=C(C=C(C=C1)C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N)OCC
InChI=1SC23H28N2O4c15928178714(1018(17)2762)2015(1324)22(25)29191223(34)1116(26)21(19)20h781020H569111225H214H3
MFCD02950141
ZINC000001837073
ZINC000001837074
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