Vitas-M small molecule compound
3-(4-acetylpiperazin-1-yl)-4-[(4-chlorobenzyl)amino]cyclobut-3-ene-1,2-dione
Catalog ID
STL159363
SMILES Clc1ccc(cc1)CNC1=C(C(=O)C1=O)N1CCN(CC1)C(=O)C
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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)19-10-12-2-4-13(18)5-3-12/h2-5,19H,6-10H2,1H3InChIKey
HDVVUWDXPFNEKG-UHFFFAOYSA-NSynonyms
1324076-54-11324076541
3(4acetylpiperazin1yl)4((4chlorobenzyl)amino)cyclobut3ene12dione
3(4acetylpiperazin1yl)4((4chlorophenyl)methylamino)cyclobut3ene12dione
CC(=O)N1CCN(CC1)C2=C(C(=O)C2=O)NCC3=CC=C(C=C3)Cl
InChI=1SC17H18ClN3O3c111(22)206821(9720)1514(16(23)17(15)24)1910122413(18)5312h2519H610H21H3
MFCD19710538
ZINC000101712152
ZINC101712152
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