Vitas-M small molecule compound

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

Catalog ID
STK935373
SMILES N#Cc1c(nc(c2c1CCCC2)CC(C)C)N1CCN(CC1)C(=O)C(=O)NCc1ccccc1

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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 C27H33N5O2 MW 459.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33N5O2/c1-19(2)16-24-22-11-7-6-10-21(22)23(17-28)25(30-24)31-12-14-32(15-13-31)27(34)26(33)29-18-20-8-4-3-5-9-20/h3-5,8-9,19H,6-7,10-16,18H2,1-2H3,(H,29,33)
InChIKey
BFCDULCJZYDQIR-UHFFFAOYSA-N
Synonyms
921097-30-5
921097305
CC(C)CC1=C2CCCCC2=C(C(=N1)N3CCN(CC3)C(=O)C(=O)NCC4=CC=CC=C4)C#N
InChI=1SC27H33N5O2c119(2)16242211761021(22)23(1728)25(3024)31121432(151331)27(34)26(33)2918208435920h358919H67101618H212H3(H2933)
MFCD08746567
Nbenzyl2(4(4cyano1(2methylpropyl)5678tetrahydroisoquinolin3yl)piperazin1yl)2oxoacetamide
Nbenzyl2(4(4cyano1isobutyl5678tetrahydroisoquinolin3yl)piperazin1yl)2oxoacetamide
ZINC000020622238
ZINC20622238

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Available files

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