Vitas-M small molecule compound
6-amino-8-(4-butoxy-3-methoxyphenyl)-2-(propan-2-yl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Catalog ID
STL335735
SMILES CCCCOc1ccc(cc1OC)C1C2CN(CC=C2C(=C(C1(C#N)C#N)N)C#N)C(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 C26H31N5O2 MW 445.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N5O2/c1-5-6-11-33-22-8-7-18(12-23(22)32-4)24-21-14-31(17(2)3)10-9-19(21)20(13-27)25(30)26(24,15-28)16-29/h7-9,12,17,21,24H,5-6,10-11,14,30H2,1-4H3InChIKey
XMWWRSMUDVJIOE-UHFFFAOYSA-NSynonyms
445222-44-6445222446
6amino8(4butoxy3methoxyphenyl)2(propan2yl)2388atetrahydroisoquinoline577(1H)tricarbonitrile
6amino8(4butoxy3methoxyphenyl)2isopropyl2388atetrahydroisoquinoline577(1H)tricarbonitrile
6amino8(4butoxy3methoxyphenyl)2propan2yl1388atetrahydroisoquinoline577tricarbonitrile
CCCCOC1=C(C=C(C=C1)C2C3CN(CC=C3C(=C(C2(C#N)C#N)N)C#N)C(C)C)OC
InChI=1SC26H31N5O2c1561133228718(1223(22)324)24211431(17(2)3)10919(21)20(1327)25(30)26(241528)1629h7912172124H5610111430H214H3
MFCD02949192
ZINC000020130164
ZINC000020130173
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