Vitas-M small molecule compound
2-(butylsulfanyl)-3-(cyclohexylmethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK833299
SMILES CCCCSc1nc2c3ccccc3CC3(c2c(=O)n1CC1CCCCC1)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 C27H36N2OS MW 436.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H36N2OS/c1-2-3-17-31-26-28-24-22-14-8-7-13-21(22)18-27(15-9-10-16-27)23(24)25(30)29(26)19-20-11-5-4-6-12-20/h7-8,13-14,20H,2-6,9-12,15-19H2,1H3InChIKey
KGQSMAKJQOLUCY-UHFFFAOYSA-NSynonyms
332024-70-12(butylsulfanyl)3(cyclohexylmethyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
2(BUTYLSULFANYL)3(CYCLOHEXYLMETHYL)56DIHYDROSPIRO(BENZO(H)QUINAZOLINE51CYCLOPENTANE)4(3H)ONE
2(butylthio)3(cyclohexylmethyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
2BUTYLSULFANYL3(CYCLOHEXYLMETHYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
2BUTYLTHIO3(CYCLOHEXYLMETHYL)SPIRO(356TRIHYDROBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
332024701
CCCCSC1=NC2=C(C(=O)N1CC3CCCCC3)C4(CCCC4)CC5=CC=CC=C52
InChI=1SC27H36N2OSc12317312628242214871321(22)1827(159101627)23(24)25(30)29(26)1920115461220h78131420H269121519H21H3
MFCD01175084
ZINC000002060617
ZINC02060617
ZINC2060617
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