Vitas-M small molecule compound
12-butyl-9-(butylsulfanyl)-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclopentan]-7(12H)-one
Catalog ID
STK552241
SMILES CCCCn1c2c3ccccc3CC3(c2c(=O)n2c1nnc2SCCCC)CCCC3
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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 C25H32N4OS MW 436.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N4OS/c1-3-5-15-28-21-19-12-8-7-11-18(19)17-25(13-9-10-14-25)20(21)22(30)29-23(28)26-27-24(29)31-16-6-4-2/h7-8,11-12H,3-6,9-10,13-17H2,1-2H3InChIKey
QHQACCRMHQNLKB-UHFFFAOYSA-NSynonyms
799840-18-912butyl9(butylsulfanyl)5Hspiro(benzo(h)(124)triazolo(34b)quinazoline61cyclopentan)7(12H)one
12butyl9(butylthio)5Hspiro(benzo(h)(124)triazolo(34b)quinazoline61cyclopentan)7(12H)one
799840189
CCCCN1C2=C(C(=O)N3C1=NN=C3SCCCC)C4(CCCC4)CC5=CC=CC=C52
InChI=1SC25H32N4OSc1351528211912871118(19)1725(139101425)20(21)22(30)2923(28)262724(29)3116642h781112H369101317H212H3
MFCD03686208
ZINC000002247741
ZINC02247741
ZINC2247741
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