Vitas-M small molecule compound
2-(benzylsulfanyl)-3-(furan-2-ylmethyl)-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK543374
SMILES O=C1N(Cc2ccco2)C(SCc2ccccc2)NC2=C1C1(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 C29H30N2O2S MW 470.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O2S/c32-27-25-26(24-14-6-5-12-22(24)18-29(25)15-7-2-8-16-29)30-28(31(27)19-23-13-9-17-33-23)34-20-21-10-3-1-4-11-21/h1,3-6,9-14,17,28,30H,2,7-8,15-16,18-20H2InChIKey
UCMSITZREYAFFZ-UHFFFAOYSA-NSynonyms
488853-60-72(benzylsulfanyl)3(furan2ylmethyl)23dihydro1Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2(benzylthio)3(furan2ylmethyl)23dihydro1Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2BENZYLSULFANYL3(FURAN2YLMETHYL)SPIRO(26DIHYDRO1HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
488853607
C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=O)N(C(N4)SCC5=CC=CC=C5)CC6=CC=CO6
InChI=1SC29H30N2O2Sc32272526(2414651222(24)1829(25)157281629)3028(31(27)1923139173323)342021103141121h136914172830H27815161820H2
MFCD03294802
ZINC000001867808
ZINC000001867809
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