Vitas-M small molecule compound
2-(benzylsulfanyl)-3-(prop-2-en-1-yl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK833094
SMILES C=CCn1c(SCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
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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/c1-2-17-29-25(30)23-24(28-26(29)31-19-20-11-5-3-6-12-20)22-14-8-7-13-21(22)18-27(23)15-9-4-10-16-27/h2-3,5-8,11-14H,1,4,9-10,15-19H2InChIKey
KSEGLGJSSBNJML-UHFFFAOYSA-NSynonyms
353787-50-52(benzylsulfanyl)3(prop2en1yl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2BENZYLSULFANYL3PROP2ENYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
353787505
3ALLYL2(BENZYLSULFANYL)56DIHYDROSPIRO(BENZO(H)QUINAZOLINE51CYCLOHEXANE)4(3H)ONE
3allyl2(benzylthio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
C=CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC5=CC=CC=C5
InChI=1SC27H28N2OSc12172925(30)2324(2826(29)311920115361220)2214871321(22)1827(23)1594101627h23581114H149101519H2
MFCD01175037
ZINC000001794885
ZINC01794885
ZINC1794885
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