Vitas-M small molecule compound
2-[(3-ethyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
Catalog ID
STK558237
SMILES CCn1c(SCC(=O)Nc2cccc(c2)C(F)(F)F)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
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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 C28H28F3N3O2S MW 527.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28F3N3O2S/c1-2-34-25(36)23-24(21-12-5-4-9-18(21)16-27(23)13-6-3-7-14-27)33-26(34)37-17-22(35)32-20-11-8-10-19(15-20)28(29,30)31/h4-5,8-12,15H,2-3,6-7,13-14,16-17H2,1H3,(H,32,35)InChIKey
TVMZNWGQRBCXBJ-UHFFFAOYSA-NSynonyms
585564-25-62((3ethyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)N(3(trifluoromethyl)phenyl)acetamide
2((3ethyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)N(3(trifluoromethyl)phenyl)acetamide
2(3ETHYL4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLN(3(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
585564256
CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)NC5=CC=CC(=C5)C(F)(F)F
InChI=1SC28H28F3N3O2Sc123425(36)2324(211254918(21)1627(23)136371427)3326(34)371722(35)32201181019(1520)28(2930)31h4581215H236713141617H21H3(H3235)
MFCD04030914
ZINC000002393836
ZINC02393836
ZINC2393836
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