Vitas-M small molecule compound
3-[4-(4-fluorophenyl)piperazin-1-yl]-4-{[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]amino}cyclobut-3-ene-1,2-dione
Catalog ID
STL161530
SMILES Fc1ccc(cc1)N1CCN(CC1)C1=C(C(=O)C1=O)NCc1c(C)nn(c1C)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 C21H24FN5O2 MW 397.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24FN5O2/c1-13-17(14(2)25(3)24-13)12-23-18-19(21(29)20(18)28)27-10-8-26(9-11-27)16-6-4-15(22)5-7-16/h4-7,23H,8-12H2,1-3H3InChIKey
CEBXKURZWAHRGI-UHFFFAOYSA-NSynonyms
1282131-18-31282131183
3(4(4fluorophenyl)piperazin1yl)4(((135trimethyl1Hpyrazol4yl)methyl)amino)cyclobut3ene12dione
3(4(4fluorophenyl)piperazin1yl)4((135trimethylpyrazol4yl)methylamino)cyclobut3ene12dione
CC1=C(C(=NN1C)C)CNC2=C(C(=O)C2=O)N3CCN(CC3)C4=CC=C(C=C4)F
InChI=1SC21H24FN5O2c11317(14(2)25(3)2413)12231819(21(29)20(18)28)2710826(91127)166415(22)5716h4723H812H213H3
MFCD18796497
ZINC000101690552
ZINC101690552
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