Vitas-M small molecule compound
2-(hexylsulfanyl)-3-(3-methylphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK543207
SMILES CCCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCC3
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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 C29H34N2OS MW 458.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2OS/c1-3-4-5-10-18-33-28-30-26-24-15-7-6-13-22(24)20-29(16-8-9-17-29)25(26)27(32)31(28)23-14-11-12-21(2)19-23/h6-7,11-15,19H,3-5,8-10,16-18,20H2,1-2H3InChIKey
FHDQATGBMQBSNG-UHFFFAOYSA-NSynonyms
488705-19-72(hexylsulfanyl)3(3methylphenyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
2(hexylthio)3(mtolyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
2HEXYLSULFANYL3(3METHYLPHENYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
488705197
CCCCCCSC1=NC2=C(C(=O)N1C3=CC=CC(=C3)C)C4(CCCC4)CC5=CC=CC=C52
InChI=1SC29H34N2OSc13451018332830262415761322(24)2029(16891729)25(26)27(32)31(28)2314111221(2)1923h67111519H35810161820H212H3
MFCD03290448
ZINC000001825645
ZINC01825645
ZINC1825645
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