Vitas-M small molecule compound
2-(benzylsulfanyl)-3-propyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK548417
SMILES CCCn1c(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 C27H30N2OS MW 430.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2OS/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/h3,5-8,11-14H,2,4,9-10,15-19H2,1H3InChIKey
KOMLPGNAMFTEEG-UHFFFAOYSA-NSynonyms
500145-56-22(benzylsulfanyl)3propyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2(benzylthio)3propyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2BENZYLSULFANYL3PROPYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
500145562
CCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC5=CC=CC=C5
InChI=1SC27H30N2OSc12172925(30)2324(2826(29)311920115361220)2214871321(22)1827(23)1594101627h3581114H249101519H21H3
MFCD03304500
ZINC000002358848
ZINC02358848
ZINC2358848
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