Vitas-M small molecule compound
12-benzyl-9-(benzylsulfanyl)-6,6-dimethyl-6,12-dihydrobenzo[h][1,2,4]triazolo[3,4-b]quinazolin-7(5H)-one
Catalog ID
STK554930
SMILES O=c1n2c(SCc3ccccc3)nnc2n(c2c1C(C)(C)Cc1c2cccc1)Cc1ccccc1
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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 C29H26N4OS MW 478.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N4OS/c1-29(2)17-22-15-9-10-16-23(22)25-24(29)26(34)33-27(32(25)18-20-11-5-3-6-12-20)30-31-28(33)35-19-21-13-7-4-8-14-21/h3-16H,17-19H2,1-2H3InChIKey
VIPDAQYXSQAVSE-UHFFFAOYSA-NSynonyms
840485-68-912benzyl9(benzylsulfanyl)66dimethyl612dihydrobenzo(h)(124)triazolo(34b)quinazolin7(5H)one
12benzyl9(benzylthio)66dimethyl56dihydrobenzo(h)(124)triazolo(34b)quinazolin7(12H)one
840485689
CC1(CC2=CC=CC=C2C3=C1C(=O)N4C(=NN=C4SCC5=CC=CC=C5)N3CC6=CC=CC=C6)C
InChI=1SC29H26N4OSc129(2)1722159101623(22)2524(29)26(34)3327(32(25)1820115361220)303128(33)351921137481421h316H1719H212H3
MFCD04007641
ZINC000002264997
ZINC2264997
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