Vitas-M small molecule compound
N-butyl-2-cyano-2-(3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoxalin-2-yl)acetamide
Catalog ID
STL330248
SMILES CCCCNC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)c1cccc(c1)C(F)(F)F)C#N
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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 C26H27F3N6O MW 496.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27F3N6O/c1-2-3-11-31-25(36)20(17-30)23-24(33-22-10-5-4-9-21(22)32-23)35-14-12-34(13-15-35)19-8-6-7-18(16-19)26(27,28)29/h4-10,16,20H,2-3,11-15H2,1H3,(H,31,36)InChIKey
KFQOWXSTXWTIEN-UHFFFAOYSA-NSynonyms
CCCCNC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F
InChI=1SC26H27F3N6Oc123113125(36)20(1730)2324(33221054921(22)3223)35141234(131535)1986718(1619)26(2728)29h4101620H231115H21H3(H3136)
MFCD02992804
Nbutyl2cyano2(3(4(3(trifluoromethyl)phenyl)piperazin1yl)quinoxalin2yl)acetamide
ZINC000009353386
ZINC000009353388
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