Vitas-M small molecule compound
3-(2-methylphenyl)-2-[(2-methylprop-2-en-1-yl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK835797
SMILES CC(=C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)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 C27H28N2OS MW 428.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2OS/c1-18(2)17-31-26-28-24-21-12-6-5-11-20(21)16-27(14-8-9-15-27)23(24)25(30)29(26)22-13-7-4-10-19(22)3/h4-7,10-13H,1,8-9,14-17H2,2-3H3InChIKey
DYKIIDUHIXADND-UHFFFAOYSA-NSynonyms
2((2methylallyl)thio)3(otolyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3(2METHYLPHENYL)2((2METHYL2PROPENYL)SULFANYL)56DIHYDROSPIRO(BENZO(H)QUINAZOLINE51CYCLOPENTANE)4(3H)ONE
3(2methylphenyl)2((2methylprop2en1yl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3(2METHYLPHENYL)2(2METHYLPROP2ENYLSULFANYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
CC1=CC=CC=C1N2C(=O)C3=C(C4=CC=CC=C4CC35CCCC5)N=C2SCC(=C)C
InChI=1SC27H28N2OSc118(2)17312628242112651120(21)1627(14891527)23(24)25(30)29(26)2213741019(22)3h471013H1891417H223H3
MFCD02763686
ZINC000001805261
ZINC01805261
ZINC1805261
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