Vitas-M small molecule compound
2-[4-(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)piperazin-1-yl]-N-(3-hydroxypropyl)-2-oxoacetamide
Catalog ID
STL239769
SMILES OCCCNC(=O)C(=O)N1CCN(CC1)c1nc(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 C20H27N5O3 MW 385.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N5O3/c1-14-15-5-2-3-6-16(15)17(13-21)18(23-14)24-8-10-25(11-9-24)20(28)19(27)22-7-4-12-26/h26H,2-12H2,1H3,(H,22,27)InChIKey
BEENWHHPEFZUTC-UHFFFAOYSA-NSynonyms
929856-65-52(4(4cyano1methyl5678tetrahydroisoquinolin3yl)piperazin1yl)N(3hydroxypropyl)2oxoacetamide
929856655
CC1=C2CCCCC2=C(C(=N1)N3CCN(CC3)C(=O)C(=O)NCCCO)C#N
InChI=1SC20H27N5O3c11415523616(15)17(1321)18(2314)2481025(11924)20(28)19(27)22741226h26H212H21H3(H2227)
MFCD09846528
ZINC000020648363
ZINC20648363
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