Vitas-M small molecule compound
2-(benzylsulfanyl)-6,6-dimethyl-9-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK210440
SMILES O=C1CC(C)(C)CC2=C1C(c1ccccc1)n1c(N2)nc(n1)SCc1ccccc1
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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 C24H24N4OS MW 416.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N4OS/c1-24(2)13-18-20(19(29)14-24)21(17-11-7-4-8-12-17)28-22(25-18)26-23(27-28)30-15-16-9-5-3-6-10-16/h3-12,21H,13-15H2,1-2H3,(H,25,26,27)InChIKey
OQPDXRJRDALZIQ-UHFFFAOYSA-NSynonyms
536984-37-92(benzylsulfanyl)66dimethyl9phenyl5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
2benzylsulfanyl66dimethyl9phenyl1579tetrahydro(124)triazolo(51b)quinazolin8one
536984379
CC1(CC2=C(C(N3C(=N2)N=C(N3)SCC4=CC=CC=C4)C5=CC=CC=C5)C(=O)C1)C
InChI=1SC24H24N4OSc124(2)131820(19(29)1424)21(17117481217)2822(2518)2623(2728)30151695361016h31221H1315H212H3(H252627)
MFCD04457050
ZINC000004575910
ZINC000004575911
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