Vitas-M small molecule compound

2-(methylsulfanyl)-3-(2-phenylethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one

Catalog ID
STK833376
SMILES CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3

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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 C26H28N2OS MW 416.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2OS/c1-30-25-27-23-21-13-7-6-12-20(21)18-26(15-8-3-9-16-26)22(23)24(29)28(25)17-14-19-10-4-2-5-11-19/h2,4-7,10-13H,3,8-9,14-18H2,1H3
InChIKey
MSBHFLLZCNTNOL-UHFFFAOYSA-N
Synonyms
332024-84-7
2(methylsulfanyl)3(2phenylethyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2(METHYLSULFANYL)3(2PHENYLETHYL)56DIHYDROSPIRO(BENZO(H)QUINAZOLINE51CYCLOHEXANE)4(3H)ONE
2(methylthio)3phenethyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2methylsulfanyl3(2phenylethyl)spiro(6Hbenzo(h)quinazoline51cyclohexane)4one
2METHYLSULFANYL3PHENETHYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
332024847
CSC1=NC2=C(C(=O)N1CCC3=CC=CC=C3)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC26H28N2OSc1302527232113761220(21)1826(158391626)22(23)24(29)28(25)171419104251119h2471013H3891418H21H3
MFCD01175122
ZINC000001834333
ZINC01834333
ZINC1834333

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Available files

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