Vitas-M small molecule compound
3-{[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]amino}-4-[4-(4-fluorophenyl)piperazin-1-yl]cyclobut-3-ene-1,2-dione
Catalog ID
STL156939
SMILES COc1ccc(cc1)C(N(C)C)CNC1=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 C25H29FN4O3 MW 452.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29FN4O3/c1-28(2)21(17-4-10-20(33-3)11-5-17)16-27-22-23(25(32)24(22)31)30-14-12-29(13-15-30)19-8-6-18(26)7-9-19/h4-11,21,27H,12-16H2,1-3H3InChIKey
QJRVBPCBBIDHRW-UHFFFAOYSA-NSynonyms
1282107-69-01282107690
3((2(dimethylamino)2(4methoxyphenyl)ethyl)amino)4(4(4fluorophenyl)piperazin1yl)cyclobut3ene12dione
CN(C)C(CNC1=C(C(=O)C1=O)N2CCN(CC2)C3=CC=C(C=C3)F)C4=CC=C(C=C4)OC
InChI=1SC25H29FN4O3c128(2)21(1741020(333)11517)16272223(25(32)24(22)31)30141229(131530)198618(26)7919h4112127H1216H213H3
MFCD18796952
ZINC000101692018
ZINC000101692027
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