Vitas-M small molecule compound
2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-5,5-dimethyl-3-(2-methylprop-2-en-1-yl)-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Catalog ID
STK700123
SMILES CC(=C)Cn1c(SCC(=O)c2ccc(cc2)Cl)nc2c(c1=O)C(C)(C)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 C26H25ClN2O2S MW 465.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN2O2S/c1-16(2)14-29-24(31)22-23(20-8-6-5-7-18(20)13-26(22,3)4)28-25(29)32-15-21(30)17-9-11-19(27)12-10-17/h5-12H,1,13-15H2,2-4H3InChIKey
GQCXWNHELRIBIO-UHFFFAOYSA-NSynonyms
328071-46-12((2(4chlorophenyl)2oxoethyl)sulfanyl)55dimethyl3(2methylprop2en1yl)56dihydrobenzo(h)quinazolin4(3H)one
2((2(4chlorophenyl)2oxoethyl)thio)55dimethyl3(2methylallyl)56dihydrobenzo(h)quinazolin4(3H)one
2(2(4CHLOROPHENYL)2OXOETHYL)SULFANYL55DIMETHYL3(2METHYLPROP2ENYL)6HBENZO(H)QUINAZOLIN4ONE
328071461
CC(=C)CN1C(=O)C2=C(C3=CC=CC=C3CC2(C)C)N=C1SCC(=O)C4=CC=C(C=C4)Cl
InChI=1SC26H25ClN2O2Sc116(2)142924(31)2223(20865718(20)1326(223)4)2825(29)321521(30)1791119(27)121017h512H11315H224H3
MFCD01558018
ZINC000002208442
ZINC02208442
ZINC2208442
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