Vitas-M small molecule compound
3-(2-methylprop-2-en-1-yl)-2-{[2-oxo-2-(thiophen-2-yl)ethyl]sulfanyl}-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK558219
SMILES CC(=C)Cn1c(SCC(=O)c2cccs2)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 C27H28N2O2S2 MW 476.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O2S2/c1-18(2)16-29-25(31)23-24(28-26(29)33-17-21(30)22-11-8-14-32-22)20-10-5-4-9-19(20)15-27(23)12-6-3-7-13-27/h4-5,8-11,14H,1,3,6-7,12-13,15-17H2,2H3InChIKey
QADMCSYOLBUGJP-UHFFFAOYSA-NSynonyms
585563-00-43(2methylallyl)2((2oxo2(thiophen2yl)ethyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(2methylprop2en1yl)2((2oxo2(thiophen2yl)ethyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(2METHYLPROP2ENYL)2(2OXO2THIOPHEN2YLETHYL)SULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
585563004
CC(=C)CN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)C5=CC=CS5
InChI=1SC27H28N2O2S2c118(2)162925(31)2324(2826(29)331721(30)22118143222)201054919(20)1527(23)126371327h4581114H136712131517H22H3
MFCD04030788
ZINC000002393677
ZINC02393677
ZINC2393677
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