Vitas-M small molecule compound
2-amino-4-{5-[(2,6-dimethoxyphenoxy)methyl]-2,4-dimethylphenyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STL175734
SMILES N#CC1=C(N)OC2=C(C1c1cc(COc3c(OC)cccc3OC)c(cc1C)C)C(=O)CC(C2)(C)C
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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 C29H32N2O5 MW 488.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N2O5/c1-16-10-17(2)19(11-18(16)15-35-27-22(33-5)8-7-9-23(27)34-6)25-20(14-30)28(31)36-24-13-29(3,4)12-21(32)26(24)25/h7-11,25H,12-13,15,31H2,1-6H3InChIKey
DKHYRRRJLZAWMD-UHFFFAOYSA-NSynonyms
438223-99-52amino4(5((26dimethoxyphenoxy)methyl)24dimethylphenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carbonitrile
2AMINO4(5((26DIMETHOXYPHENOXY)METHYL)24DIMETHYLPHENYL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBONITRILE
438223995
CC1=CC(=C(C=C1C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N)COC4=C(C=CC=C4OC)OC)C
InChI=1SC29H32N2O5c1161017(2)19(1118(16)15352722(335)87923(27)346)2520(1430)28(31)36241329(34)1221(32)26(24)25h71125H12131531H216H3
MFCD03074774
ZINC000000651015
ZINC000000651017
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