Vitas-M small molecule compound
3-benzyl-2-(butylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK774966
SMILES CCCCSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)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 C27H30N2OS MW 430.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2OS/c1-2-3-17-31-26-28-24-22-14-8-7-13-21(22)18-27(15-9-10-16-27)23(24)25(30)29(26)19-20-11-5-4-6-12-20/h4-8,11-14H,2-3,9-10,15-19H2,1H3InChIKey
PLRGUFQCTKZJTG-UHFFFAOYSA-NSynonyms
380667-24-3380667243
3benzyl2(butylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3benzyl2(butylthio)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3BENZYL2BUTYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
CCCCSC1=NC2=C(C(=O)N1CC3=CC=CC=C3)C4(CCCC4)CC5=CC=CC=C52
InChI=1SC27H30N2OSc12317312628242214871321(22)1827(159101627)23(24)25(30)29(26)1920115461220h481114H239101519H21H3
MFCD03678012
ZINC000002222436
ZINC02222436
ZINC2222436
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