Vitas-M small molecule compound
2-[(3,4-dichlorobenzyl)sulfanyl]-3-(2-methylprop-2-en-1-yl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK000131
SMILES CC(=C)Cn1c(SCc2ccc(c(c2)Cl)Cl)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 C28H28Cl2N2OS MW 511.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28Cl2N2OS/c1-18(2)16-32-26(33)24-25(31-27(32)34-17-19-10-11-22(29)23(30)14-19)21-9-5-4-8-20(21)15-28(24)12-6-3-7-13-28/h4-5,8-11,14H,1,3,6-7,12-13,15-17H2,2H3InChIKey
OINXAJDCGPRWCZ-UHFFFAOYSA-NSynonyms
330827-55-92((34DICHLOROBENZYL)SULFANYL)3(2METHYLPROP2EN1YL)3HSPIRO(BENZO(H)QUINAZOLINE51CYCLOHEXAN)4(6H)ONE
2((34dichlorobenzyl)thio)3(2methylallyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((34DICHLOROPHENYL)METHYLSULFANYL)3(2METHYLPROP2ENYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
2((34DICHLOROPHENYL)METHYLTHIO)3(2METHYLPROP2ENYL)SPIRO(356TRIHYDROBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
330827559
CC(=C)CN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC5=CC(=C(C=C5)Cl)Cl
CC(=C)Cn1c(SCc2ccc(c(c2)Cl)Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
InChI=1SC28H28Cl2N2OSc118(2)163226(33)2425(3127(32)341719101122(29)23(30)1419)21954820(21)1528(24)126371328h4581114H136712131517H22H3
MFCD01559222
STK000131
ZINC000002254726
ZINC02254726
ZINC2254726
Check stock
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Check stock on Vitas-MAvailable files
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