Vitas-M small molecule compound
3-[4-(4-fluorophenyl)piperazin-1-yl]-4-{[2-(4-hydroxyphenyl)ethyl]amino}cyclobut-3-ene-1,2-dione
Catalog ID
STL157104
SMILES Oc1ccc(cc1)CCNC1=C(C(=O)C1=O)N1CCN(CC1)c1ccc(cc1)F
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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 C22H22FN3O3 MW 395.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22FN3O3/c23-16-3-5-17(6-4-16)25-11-13-26(14-12-25)20-19(21(28)22(20)29)24-10-9-15-1-7-18(27)8-2-15/h1-8,24,27H,9-14H2InChIKey
MBWPWPHKEGGEFG-UHFFFAOYSA-NSynonyms
1282112-25-71282112257
3(4(4fluorophenyl)piperazin1yl)4((2(4hydroxyphenyl)ethyl)amino)cyclobut3ene12dione
3(4(4fluorophenyl)piperazin1yl)4((4hydroxyphenethyl)amino)cyclobut3ene12dione
3(4(4fluorophenyl)piperazin1yl)4(2(4hydroxyphenyl)ethylamino)cyclobut3ene12dione
C1CN(CCN1C2=CC=C(C=C2)F)C3=C(C(=O)C3=O)NCCC4=CC=C(C=C4)O
InChI=1SC22H22FN3O3c23163517(6416)25111326(141225)2019(21(28)22(20)29)24109151718(27)8215h182427H914H2
MFCD18798321
ZINC000101696462
ZINC101696462
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