Vitas-M small molecule compound
3-(4-methoxyphenyl)-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK541379
SMILES COc1ccc(cc1)n1c(SCC(=O)N2CCCCC2)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 C31H35N3O3S MW 529.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H35N3O3S/c1-37-24-14-12-23(13-15-24)34-29(36)27-28(32-30(34)38-21-26(35)33-18-8-3-9-19-33)25-11-5-4-10-22(25)20-31(27)16-6-2-7-17-31/h4-5,10-15H,2-3,6-9,16-21H2,1H3InChIKey
LNANUJMWTMMUQB-UHFFFAOYSA-NSynonyms
488717-58-43(4methoxyphenyl)2((2oxo2(piperidin1yl)ethyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(4methoxyphenyl)2((2oxo2(piperidin1yl)ethyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(4METHOXYPHENYL)2(2OXO2PIPERIDIN1YLETHYL)SULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
488717584
COC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)N6CCCCC6
InChI=1SC31H35N3O3Sc13724141223(131524)3429(36)2728(3230(34)382126(35)33188391933)2511541022(25)2031(27)166271731h451015H23691621H21H3
MFCD03291134
ZINC000001867763
ZINC01867763
ZINC1867763
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