Vitas-M small molecule compound
2-[(3-methylbutyl)sulfanyl]-3-(2-phenylethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK549912
SMILES CC(CCSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3)C
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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 C29H34N2OS MW 458.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2OS/c1-21(2)15-19-33-28-30-26-24-13-7-6-12-23(24)20-29(16-8-9-17-29)25(26)27(32)31(28)18-14-22-10-4-3-5-11-22/h3-7,10-13,21H,8-9,14-20H2,1-2H3InChIKey
XVOVQQCBVSSIAC-UHFFFAOYSA-NSynonyms
380667-33-42((3methylbutyl)sulfanyl)3(2phenylethyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
2(3methylbutylsulfanyl)3(2phenylethyl)spiro(6Hbenzo(h)quinazoline51cyclopentane)4one
2(3METHYLBUTYLSULFANYL)3PHENETHYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
2(isopentylthio)3phenethyl3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
380667334
CC(C)CCSC1=NC2=C(C(=O)N1CCC3=CC=CC=C3)C4(CCCC4)CC5=CC=CC=C52
InChI=1SC29H34N2OSc121(2)1519332830262413761223(24)2029(16891729)25(26)27(32)31(28)181422104351122h37101321H891420H212H3
MFCD03675097
ZINC000009076173
ZINC09076173
ZINC9076173
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