Vitas-M small molecule compound
2-[(2,4-dichlorobenzyl)sulfanyl]-3-(3-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK543092
SMILES COc1cccc(c1)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 C31H28Cl2N2O2S MW 563.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28Cl2N2O2S/c1-37-24-10-7-9-23(17-24)35-29(36)27-28(34-30(35)38-19-21-12-13-22(32)16-26(21)33)25-11-4-3-8-20(25)18-31(27)14-5-2-6-15-31/h3-4,7-13,16-17H,2,5-6,14-15,18-19H2,1H3InChIKey
FYQZQXPORPGMLB-UHFFFAOYSA-NSynonyms
2((24dichlorobenzyl)sulfanyl)3(3methoxyphenyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((24dichlorobenzyl)thio)3(3methoxyphenyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((24DICHLOROPHENYL)METHYLSULFANYL)3(3METHOXYPHENYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
COC1=CC=CC(=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC6=C(C=C(C=C6)Cl)Cl
InChI=1SC31H28Cl2N2O2Sc13724107923(1724)3529(36)2728(3430(35)381921121322(32)1626(21)33)251143820(25)1831(27)145261531h347131617H25614151819H21H3
MFCD03292647
ZINC000001843511
ZINC01843511
ZINC1843511
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