Vitas-M small molecule compound

3-(2-methylprop-2-en-1-yl)-2-thioxo-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one

Catalog ID
STK984441
SMILES CC(=C)Cn1c(=S)[nH]c2c(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 C21H24N2OS MW 352.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2OS/c1-14(2)13-23-19(24)17-18(22-20(23)25)16-9-5-4-8-15(16)12-21(17)10-6-3-7-11-21/h4-5,8-9H,1,3,6-7,10-13H2,2H3,(H,22,25)
InChIKey
VOSLPTBXRHDNEW-UHFFFAOYSA-N
Synonyms
352706-01-5
3(2methylallyl)2thioxo23dihydro1Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(2methylprop2en1yl)2thioxo23dihydro1Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(2METHYLPROP2ENYL)2SULFANYLIDENESPIRO(16DIHYDROBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CC(=C)Cn1c(=S)(nH)c2c(c1=O)C1(CCCCC1)Cc1c2cccc1
MFCD01558285
ZINC01248540
ZINC1248540

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.