Vitas-M small molecule compound
9-(1,3-benzodioxol-5-yl)-6,6-dimethyl-5,6,7,9-tetrahydrotetrazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK333670
SMILES O=C1CC(C)(C)CC2=C1C(c1ccc3c(c1)OCO3)n1c(N2)nnn1
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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 C17H17N5O3 MW 339.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N5O3/c1-17(2)6-10-14(11(23)7-17)15(22-16(18-10)19-20-21-22)9-3-4-12-13(5-9)25-8-24-12/h3-5,15H,6-8H2,1-2H3,(H,18,19,21)InChIKey
PSNOTQHXRYMXSP-UHFFFAOYSA-NSynonyms
9(13benzodioxol5yl)66dimethyl1579tetrahydrotetrazolo(51b)quinazolin8one
9(13benzodioxol5yl)66dimethyl5679tetrahydrotetrazolo(51b)quinazolin8(4H)one
CC1(CC2=C(C(N3C(=N2)N=NN3)C4=CC5=C(C=C4)OCO5)C(=O)C1)C
InChI=1SC17H17N5O3c117(2)61014(11(23)717)15(2216(1810)19202122)9341213(59)2582412h3515H68H212H3(H181921)
MFCD09963208
ZINC000018196168
ZINC000018196170
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