Vitas-M small molecule compound
3-(4-acetylpiperazin-1-yl)-4-[(2-chlorobenzyl)amino]cyclobut-3-ene-1,2-dione
Catalog ID
STL160009
SMILES CC(=O)N1CCN(CC1)C1=C(C(=O)C1=O)NCc1ccccc1Cl
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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 C17H18ClN3O3 MW 347.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18ClN3O3/c1-11(22)20-6-8-21(9-7-20)15-14(16(23)17(15)24)19-10-12-4-2-3-5-13(12)18/h2-5,19H,6-10H2,1H3InChIKey
DTRPSPCXFDKXGP-UHFFFAOYSA-NSynonyms
1282126-28-61282126286
3(4acetylpiperazin1yl)4((2chlorobenzyl)amino)cyclobut3ene12dione
3(4acetylpiperazin1yl)4((2chlorophenyl)methylamino)cyclobut3ene12dione
CC(=O)N1CCN(CC1)C2=C(C(=O)C2=O)NCC3=CC=CC=C3Cl
InChI=1SC17H18ClN3O3c111(22)206821(9720)1514(16(23)17(15)24)191012423513(12)18h2519H610H21H3
MFCD18799806
ZINC000101442297
ZINC101442297
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