Vitas-M small molecule compound
2-amino-4,4-dimethoxy-6-(3,4,5-trimethoxyphenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile
Catalog ID
STK523721
SMILES COc1cc(cc(c1OC)OC)C1C2(C1(C#N)C(=NC2(OC)OC)N)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 C18H20N4O5 MW 372.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O5/c1-23-11-6-10(7-12(24-2)13(11)25-3)14-16(8-19)15(21)22-18(26-4,27-5)17(14,16)9-20/h6-7,14H,1-5H3,(H2,21,22)InChIKey
XHGZCGWXHNUVAM-UHFFFAOYSA-NSynonyms
2amino44dimethoxy6(345trimethoxyphenyl)3azabicyclo(310)hex2ene15dicarbonitrile
4amino22dimethoxy6(345trimethoxyphenyl)3azabicyclo(310)hex3ene15dicarbonitrile
COC1=CC(=CC(=C1OC)OC)C2C3(C2(C(N=C3N)(OC)OC)C#N)C#N
InChI=1SC18H20N4O5c12311610(712(242)13(11)253)1416(819)15(21)2218(264275)17(1416)920h6714H15H3(H22122)
MFCD04097191
ZINC000015023376
ZINC000103028006
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