Vitas-M small molecule compound
2-amino-4-(4,7-dimethoxy-6-propyl-1,3-benzodioxol-5-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK692772
SMILES CCCc1c(C2C(=C(N)OC3=C2C(=O)CC(C3)(C)C)C#N)c(OC)c2c(c1OC)OCO2
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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 C24H28N2O6 MW 440.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O6/c1-6-7-12-17(20(29-5)22-21(19(12)28-4)30-11-31-22)16-13(10-25)23(26)32-15-9-24(2,3)8-14(27)18(15)16/h16H,6-9,11,26H2,1-5H3InChIKey
IHCGGYYQBUIXLW-UHFFFAOYSA-NSynonyms
2amino4(47dimethoxy6propyl13benzodioxol5yl)77dimethyl5oxo5678tetrahydro4Hchromene3carbonitrile
2amino4(47dimethoxy6propyl13benzodioxol5yl)77dimethyl5oxo68dihydro4Hchromene3carbonitrile
CCCC1=C(C(=C2C(=C1OC)OCO2)OC)C3C(=C(OC4=C3C(=O)CC(C4)(C)C)N)C#N
InChI=1SC24H28N2O6c1671217(20(295)2221(19(12)284)30113122)1613(1025)23(26)3215924(23)814(27)18(15)16h16H691126H215H3
MFCD10038789
ZINC000015084747
ZINC000015084749
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