Vitas-M small molecule compound

2-[(3-butyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide

Catalog ID
STK558525
SMILES CCCCn1c(SCC(=O)Nc2ccccc2C(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 C30H32F3N3O2S MW 555.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32F3N3O2S/c1-2-3-17-36-27(38)25-26(21-12-6-5-11-20(21)18-29(25)15-9-4-10-16-29)35-28(36)39-19-24(37)34-23-14-8-7-13-22(23)30(31,32)33/h5-8,11-14H,2-4,9-10,15-19H2,1H3,(H,34,37)
InChIKey
QGDQPLOYJKKHOT-UHFFFAOYSA-N
Synonyms

2((3butyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)N(2(trifluoromethyl)phenyl)acetamide
2((3butyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)N(2(trifluoromethyl)phenyl)acetamide
2(3BUTYL4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLN(2(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
CCCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)NC5=CC=CC=C5C(F)(F)F
InChI=1SC30H32F3N3O2Sc123173627(38)2526(2112651120(21)1829(25)1594101629)3528(36)391924(37)342314871322(23)30(3132)33h581114H249101519H21H3(H3437)
MFCD04032817
ZINC000001872664
ZINC01872664
ZINC1872664

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Available files

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