Vitas-M small molecule compound
3-benzyl-2-[(2-phenylethyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK805535
SMILES O=c1n(Cc2ccccc2)c(SCCc2ccccc2)nc2c1C1(CCCC1)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 C31H30N2OS MW 478.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N2OS/c34-29-27-28(26-16-8-7-15-25(26)21-31(27)18-9-10-19-31)32-30(33(29)22-24-13-5-2-6-14-24)35-20-17-23-11-3-1-4-12-23/h1-8,11-16H,9-10,17-22H2InChIKey
HHLSBRGVDLYWOH-UHFFFAOYSA-NSynonyms
327171-13-1327171131
3benzyl2((2phenylethyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3benzyl2(2phenylethylsulfanyl)spiro(6Hbenzo(h)quinazoline51cyclopentane)4one
3benzyl2(phenethylthio)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3BENZYL2PHENETHYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
C1CCC2(C1)CC3=CC=CC=C3C4=C2C(=O)N(C(=N4)SCCC5=CC=CC=C5)CC6=CC=CC=C6
InChI=1SC31H30N2OSc34292728(2616871525(26)2131(27)189101931)3230(33(29)2224135261424)35201723113141223h181116H9101722H2
MFCD01174974
ZINC000002207904
ZINC02207904
ZINC2207904
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