Vitas-M small molecule compound

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

Catalog ID
STK008775
SMILES CCSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCC3

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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 C22H26N2OS MW 366.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2OS/c1-4-26-21-23-19-17-10-6-5-9-16(17)13-22(11-7-8-12-22)18(19)20(25)24(21)14-15(2)3/h5-6,9-10H,2,4,7-8,11-14H2,1,3H3
InChIKey
MZKJLGOBVKKWCL-UHFFFAOYSA-N
Synonyms
353762-12-6
2(ETHYLSULFANYL)3(2METHYL2PROPENYL)56DIHYDROSPIRO(BENZO(H)QUINAZOLINE51CYCLOPENTANE)4(3H)ONE
2(ETHYLSULFANYL)3(2METHYLPROP2EN1YL)3HSPIRO(BENZO(H)QUINAZOLINE51CYCLOPENTAN)4(6H)ONE
2(ethylthio)3(2methylallyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
2ETHYLSULFANYL3(2METHYLPROP2ENYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
353762126
CCSC1=NC2=C(C(=O)N1CC(=C)C)C3(CCCC3)CC4=CC=CC=C42
CCSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCC3
InChI=1SC22H26N2OSc1426212319171065916(17)1322(11781222)18(19)20(25)24(21)1415(2)3h56910H24781114H213H3
MFCD01557259
STK008775
ZINC000000680170
ZINC00680170
ZINC680170

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Available files

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