Vitas-M small molecule compound
2-amino-4,4-diethoxy-6-(3,4,5-trimethoxyphenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile
Catalog ID
STK523730
SMILES CCOC1(OCC)N=C(C2(C1(C#N)C2c1cc(OC)c(c(c1)OC)OC)C#N)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 C20H24N4O5 MW 400.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N4O5/c1-6-28-20(29-7-2)19(11-22)16(18(19,10-21)17(23)24-20)12-8-13(25-3)15(27-5)14(9-12)26-4/h8-9,16H,6-7H2,1-5H3,(H2,23,24)InChIKey
QDYKSIOHXQHAOR-UHFFFAOYSA-NSynonyms
2amino44diethoxy6(345trimethoxyphenyl)3azabicyclo(310)hex2ene15dicarbonitrile
4amino22diethoxy6(345trimethoxyphenyl)3azabicyclo(310)hex3ene15dicarbonitrile
CCOC1(C2(C(C2(C(=N1)N)C#N)C3=CC(=C(C(=C3)OC)OC)OC)C#N)OCC
InChI=1SC20H24N4O5c162820(2972)19(1122)16(18(191021)17(23)2420)12813(253)15(275)14(912)264h8916H67H215H3(H22324)
MFCD04097192
ZINC000103027882
ZINC000230058140
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