Vitas-M small molecule compound
2-(benzylsulfanyl)-5-cyclohexyl-5-ethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Catalog ID
STK524061
SMILES CCC1(Cc2ccccc2c2c1c(=O)[nH]c(n2)SCc1ccccc1)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/c1-2-27(21-14-7-4-8-15-21)17-20-13-9-10-16-22(20)24-23(27)25(30)29-26(28-24)31-18-19-11-5-3-6-12-19/h3,5-6,9-13,16,21H,2,4,7-8,14-15,17-18H2,1H3,(H,28,29,30)InChIKey
NEKIJDOCELLVQH-UHFFFAOYSA-NSynonyms
2(benzylsulfanyl)5cyclohexyl5ethyl56dihydrobenzo(h)quinazolin4(3H)one
2BENZYLSULFANYL5CYCLOHEXYL5ETHYL16DIHYDROBENZO(H)QUINAZOLIN4ONE
2BENZYLSULFANYL5CYCLOHEXYL5ETHYL56DIHYDRO3HBENZO(H)QUINAZOLIN4ONE
CCC1(CC2=CC=CC=C2C3=C1C(=O)N=C(N3)SCC4=CC=CC=C4)C5CCCCC5
CCC1(Cc2ccccc2c2c1c(=O)(nH)c(n2)SCc1ccccc1)C1CCCCC1
InChI=1SC27H30N2OSc1227(21147481521)1720139101622(20)2423(27)25(30)2926(2824)311819115361219h3569131621H247814151718H21H3(H282930)
MFCD01819911
ZINC000006197449
ZINC000006197576
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