Vitas-M small molecule compound
12-butyl-9-(butylsulfanyl)-6,6-dimethyl-6,12-dihydrobenzo[h][1,2,4]triazolo[3,4-b]quinazolin-7(5H)-one
Catalog ID
STK845222
SMILES CCCCn1c2c3ccccc3CC(c2c(=O)n2c1nnc2SCCCC)(C)C
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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 C23H30N4OS MW 410.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N4OS/c1-5-7-13-26-19-17-12-10-9-11-16(17)15-23(3,4)18(19)20(28)27-21(26)24-25-22(27)29-14-8-6-2/h9-12H,5-8,13-15H2,1-4H3InChIKey
CLCFSKSTYMJKCH-UHFFFAOYSA-NSynonyms
573670-11-812butyl9(butylsulfanyl)66dimethyl612dihydrobenzo(h)(124)triazolo(34b)quinazolin7(5H)one
12butyl9(butylthio)66dimethyl56dihydrobenzo(h)(124)triazolo(34b)quinazolin7(12H)one
573670118
CCCCN1C2=C(C(=O)N3C1=NN=C3SCCCC)C(CC4=CC=CC=C42)(C)C
InChI=1SC23H30N4OSc15713261917121091116(17)1523(34)18(19)20(28)2721(26)242522(27)2914862h912H581315H214H3
MFCD04017428
ZINC000002841036
ZINC02841036
ZINC2841036
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