Vitas-M small molecule compound
3-(furan-2-ylmethyl)-2-(hexylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK549802
SMILES CCCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)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 C27H32N2O2S MW 448.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O2S/c1-2-3-4-9-17-32-26-28-24-22-13-6-5-11-20(22)18-27(14-7-8-15-27)23(24)25(30)29(26)19-21-12-10-16-31-21/h5-6,10-13,16H,2-4,7-9,14-15,17-19H2,1H3InChIKey
CBRMFSLTDNMOMI-UHFFFAOYSA-NSynonyms
836640-59-63(furan2ylmethyl)2(hexylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3(furan2ylmethyl)2(hexylthio)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3(FURAN2YLMETHYL)2HEXYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
836640596
CCCCCCSC1=NC2=C(C(=O)N1CC3=CC=CO3)C4(CCCC4)CC5=CC=CC=C52
InChI=1SC27H32N2O2Sc1234917322628242213651120(22)1827(14781527)23(24)25(30)29(26)19211210163121h56101316H247914151719H21H3
MFCD03690542
ZINC000009462542
ZINC09462542
ZINC9462542
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