Vitas-M small molecule compound
2-(hexylsulfanyl)-3-(2-methylprop-2-en-1-yl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK077665
SMILES CCCCCCSc1nc2c3ccccc3CC3(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 C26H34N2OS MW 422.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34N2OS/c1-4-5-6-11-16-30-25-27-23-21-13-8-7-12-20(21)17-26(14-9-10-15-26)22(23)24(29)28(25)18-19(2)3/h7-8,12-13H,2,4-6,9-11,14-18H2,1,3H3InChIKey
FLHSTFZNTFMWND-UHFFFAOYSA-NSynonyms
337495-66-62(HEXYLSULFANYL)3(2METHYLPROP2EN1YL)3HSPIRO(BENZO(H)QUINAZOLINE51CYCLOPENTAN)4(6H)ONE
2(hexylthio)3(2methylallyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
2HEXYLSULFANYL3(2METHYLPROP2ENYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
2HEXYLTHIO3(2METHYLPROP2ENYL)SPIRO(356TRIHYDROBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
337495666
CCCCCCSC1=NC2=C(C(=O)N1CC(=C)C)C3(CCCC3)CC4=CC=CC=C42
CCCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCC3
InChI=1SC26H34N2OSc14561116302527232113871220(21)1726(149101526)22(23)24(29)28(25)1819(2)3h781213H2469111418H213H3
MFCD01559177
STK077665
ZINC000002254708
ZINC02254708
ZINC2254708
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