Vitas-M small molecule compound
ethyl {4-[4-cyano-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]piperazin-1-yl}(oxo)acetate
Catalog ID
STK617780
SMILES CCOC(=O)C(=O)N1CCN(CC1)c1nc(C(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 C21H28N4O3 MW 384.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4O3/c1-4-28-21(27)20(26)25-11-9-24(10-12-25)19-17(13-22)15-7-5-6-8-16(15)18(23-19)14(2)3/h14H,4-12H2,1-3H3InChIKey
NMLZFSNLZHNTPW-UHFFFAOYSA-NSynonyms
929867-63-0929867630
CCOC(=O)C(=O)N1CCN(CC1)C2=NC(=C3CCCCC3=C2C#N)C(C)C
ethyl(4(4cyano1(propan2yl)5678tetrahydroisoquinolin3yl)piperazin1yl)(oxo)acetate
ethyl2(4(4cyano1isopropyl5678tetrahydroisoquinolin3yl)piperazin1yl)2oxoacetate
ethyl2(4(4cyano1propan2yl5678tetrahydroisoquinolin3yl)piperazin1yl)2oxoacetate
InChI=1SC21H28N4O3c142821(27)20(26)2511924(101225)1917(1322)15756816(15)18(2319)14(2)3h14H412H213H3
MFCD09789567
ZINC000020646643
ZINC20646643
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