Vitas-M small molecule compound

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

Catalog ID
STK540080
SMILES Cc1ccc(cc1)n1c(SCc2ccc(cc2Cl)Cl)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 C31H28Cl2N2OS MW 547.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28Cl2N2OS/c1-20-9-13-24(14-10-20)35-29(36)27-28(34-30(35)37-19-22-11-12-23(32)17-26(22)33)25-8-4-3-7-21(25)18-31(27)15-5-2-6-16-31/h3-4,7-14,17H,2,5-6,15-16,18-19H2,1H3
InChIKey
RTDMLHSHOJCJSH-UHFFFAOYSA-N
Synonyms
384369-57-7
2((24dichlorobenzyl)sulfanyl)3(4methylphenyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((24dichlorobenzyl)thio)3(ptolyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((24DICHLOROPHENYL)METHYLSULFANYL)3(4METHYLPHENYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
384369577
CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC6=C(C=C(C=C6)Cl)Cl
InChI=1SC31H28Cl2N2OSc12091324(141020)3529(36)2728(3430(35)371922111223(32)1726(22)33)25843721(25)1831(27)155261631h3471417H25615161819H21H3
MFCD03284800
ZINC000001801891
ZINC01801891
ZINC1801891

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Available files

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