Vitas-M small molecule compound

ethyl {4-[4-cyano-1-(2-methylpropyl)-5,6,7,8-tetrahydroisoquinolin-3-yl]piperazin-1-yl}(oxo)acetate

Catalog ID
STL240694
SMILES CCOC(=O)C(=O)N1CCN(CC1)c1nc(CC(C)C)c2c(c1C#N)CCCC2

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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 C22H30N4O3 MW 398.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N4O3/c1-4-29-22(28)21(27)26-11-9-25(10-12-26)20-18(14-23)16-7-5-6-8-17(16)19(24-20)13-15(2)3/h15H,4-13H2,1-3H3
InChIKey
ZPLSGGCHEYXOIZ-UHFFFAOYSA-N
Synonyms
919744-15-3
919744153
CCOC(=O)C(=O)N1CCN(CC1)C2=NC(=C3CCCCC3=C2C#N)CC(C)C
ethyl(4(4cyano1(2methylpropyl)5678tetrahydroisoquinolin3yl)piperazin1yl)(oxo)acetate
ethyl2(4(4cyano1(2methylpropyl)5678tetrahydroisoquinolin3yl)piperazin1yl)2oxoacetate
ethyl2(4(4cyano1isobutyl5678tetrahydroisoquinolin3yl)piperazin1yl)2oxoacetate
InChI=1SC22H30N4O3c142922(28)21(27)2611925(101226)2018(1423)16756817(16)19(2420)1315(2)3h15H413H213H3
MFCD08747631
ZINC000020622871
ZINC20622871

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Available files

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