Vitas-M small molecule compound
3-benzyl-5-cyclohexyl-5-methyl-2-(methylsulfanyl)-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Catalog ID
STK531111
SMILES CSc1nc2c3ccccc3CC(c2c(=O)n1Cc1ccccc1)(C)C1CCCCC1
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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 C27H30N2OS MW 430.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2OS/c1-27(21-14-7-4-8-15-21)17-20-13-9-10-16-22(20)24-23(27)25(30)29(26(28-24)31-2)18-19-11-5-3-6-12-19/h3,5-6,9-13,16,21H,4,7-8,14-15,17-18H2,1-2H3InChIKey
DTCOUGVHEKAOKS-UHFFFAOYSA-NSynonyms
3benzyl5cyclohexyl5methyl2(methylsulfanyl)56dihydrobenzo(h)quinazolin4(3H)one
3benzyl5cyclohexyl5methyl2(methylthio)56dihydrobenzo(h)quinazolin4(3H)one
3BENZYL5CYCLOHEXYL5METHYL2METHYLSULFANYL6HBENZO(H)QUINAZOLIN4ONE
CC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)SC)CC4=CC=CC=C4)C5CCCCC5
InChI=1SC27H30N2OSc127(21147481521)1720139101622(20)2423(27)25(30)29(26(2824)312)1819115361219h3569131621H47814151718H212H3
MFCD02242463
ZINC000001883600
ZINC000001883602
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