Vitas-M small molecule compound
3-(4-methylphenyl)-2-(prop-2-en-1-ylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK833424
SMILES C=CCSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCCC3
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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 C27H28N2OS MW 428.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2OS/c1-3-17-31-26-28-24-22-10-6-5-9-20(22)18-27(15-7-4-8-16-27)23(24)25(30)29(26)21-13-11-19(2)12-14-21/h3,5-6,9-14H,1,4,7-8,15-18H2,2H3InChIKey
FFVQSGXZVMNIFP-UHFFFAOYSA-NSynonyms
289711-77-92(ALLYLSULFANYL)3(4METHYLPHENYL)56DIHYDRO4(3H)OXOSPIRO(BENZO(H)QUINAZOLINE51CYCLOHEXANE)
2(allylthio)3(ptolyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
289711779
3(4methylphenyl)2(prop2en1ylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(4METHYLPHENYL)2PROP2ENYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
3(4METHYLPHENYL)2PROP2ENYLTHIOSPIRO(356TRIHYDROBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC=C
InChI=1SC27H28N2OSc131731262824221065920(22)1827(157481627)23(24)25(30)29(26)21131119(2)121421h356914H14781518H22H3
MFCD00688839
ZINC000002054772
ZINC02054772
ZINC2054772
Check stock
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Check stock on Vitas-MAvailable files
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