Vitas-M small molecule compound

ethyl 4-{[2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]carbonyl}piperazine-1-carboxylate

Catalog ID
STL252148
SMILES COCCn1cc(C(=O)N2CCN(CC2)C(=O)OCC)c2c(c1=O)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 C20H25N3O5 MW 387.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O5/c1-3-28-20(26)22-10-8-21(9-11-22)19(25)17-14-23(12-13-27-2)18(24)16-7-5-4-6-15(16)17/h4-7,14H,3,8-13H2,1-2H3
InChIKey
XUBUQWLVHZXHMQ-UHFFFAOYSA-N
Synonyms
1374518-94-1
1374518941
CCOC(=O)N1CCN(CC1)C(=O)C2=CN(C(=O)C3=CC=CC=C32)CCOC
ethyl4((2(2methoxyethyl)1oxo12dihydroisoquinolin4yl)carbonyl)piperazine1carboxylate
ethyl4(2(2methoxyethyl)1oxo12dihydroisoquinoline4carbonyl)piperazine1carboxylate
ethyl4(2(2methoxyethyl)1oxoisoquinoline4carbonyl)piperazine1carboxylate
InChI=1SC20H25N3O5c132820(26)2210821(91122)19(25)171423(1213272)18(24)16754615(16)17h4714H3813H212H3
MFCD22202331
ZINC000072403601
ZINC72403601

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.