Vitas-M small molecule compound
3-[4-(3-chlorophenyl)piperazin-1-yl]-4-{[3-(1H-imidazol-1-yl)propyl]amino}cyclobut-3-ene-1,2-dione
Catalog ID
STL155742
SMILES Clc1cccc(c1)N1CCN(CC1)C1=C(C(=O)C1=O)NCCCn1cncc1
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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 C20H22ClN5O2 MW 399.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22ClN5O2/c21-15-3-1-4-16(13-15)25-9-11-26(12-10-25)18-17(19(27)20(18)28)23-5-2-7-24-8-6-22-14-24/h1,3-4,6,8,13-14,23H,2,5,7,9-12H2InChIKey
LWDVFPCMGCCVNY-UHFFFAOYSA-NSynonyms
1282104-46-41282104464
3((3(1Himidazol1yl)propyl)amino)4(4(3chlorophenyl)piperazin1yl)cyclobut3ene12dione
3(4(3chlorophenyl)piperazin1yl)4((3(1Himidazol1yl)propyl)amino)cyclobut3ene12dione
3(4(3chlorophenyl)piperazin1yl)4(3imidazol1ylpropylamino)cyclobut3ene12dione
C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=O)C3=O)NCCCN4C=CN=C4
InChI=1SC20H22ClN5O2c211531416(1315)2591126(121025)1817(19(27)20(18)28)235272486221424h13468131423H257912H2
MFCD18799987
ZINC000101703057
ZINC101703057
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