Vitas-M small molecule compound

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

Catalog ID
STK938069
SMILES N#Cc1c(nc(c2c1CCCC2)CC(C)C)N1CCN(CC1)C(=O)C(=O)NCCc1ccccc1

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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 C28H35N5O2 MW 473.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H35N5O2/c1-20(2)18-25-23-11-7-6-10-22(23)24(19-29)26(31-25)32-14-16-33(17-15-32)28(35)27(34)30-13-12-21-8-4-3-5-9-21/h3-5,8-9,20H,6-7,10-18H2,1-2H3,(H,30,34)
InChIKey
KLEDZMPCXNTAQK-UHFFFAOYSA-N
Synonyms
921142-06-5
2(4(4cyano1(2methylpropyl)5678tetrahydroisoquinolin3yl)piperazin1yl)2oxoN(2phenylethyl)acetamide
2(4(4cyano1isobutyl5678tetrahydroisoquinolin3yl)piperazin1yl)2oxoNphenethylacetamide
921142065
CC(C)CC1=C2CCCCC2=C(C(=N1)N3CCN(CC3)C(=O)C(=O)NCCC4=CC=CC=C4)C#N
InChI=1SC28H35N5O2c120(2)18252311761022(23)24(1929)26(3125)32141633(171532)28(35)27(34)301312218435921h358920H671018H212H3(H3034)
MFCD08745415
ZINC000020621617
ZINC20621617

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Available files

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