Vitas-M small molecule compound

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

Catalog ID
STK547307
SMILES CCCCn1c(SC)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 C22H28N2OS MW 368.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2OS/c1-3-4-14-24-20(25)18-19(23-21(24)26-2)17-11-7-6-10-16(17)15-22(18)12-8-5-9-13-22/h6-7,10-11H,3-5,8-9,12-15H2,1-2H3
InChIKey
PPQRSRQRBLKOOB-UHFFFAOYSA-N
Synonyms
496772-64-6
3butyl2(methylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3butyl2(methylthio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3BUTYL2METHYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
496772646
CCCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SC
InChI=1SC22H28N2OSc134142420(25)1819(2321(24)262)1711761016(17)1522(18)128591322h671011H35891215H212H3
MFCD03298513
ZINC000002297239
ZINC02297239
ZINC2297239

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Available files

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