Vitas-M small molecule compound
9-(4-bromophenyl)-6,6-dimethyl-5,6,7,9-tetrahydrotetrazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK326929
SMILES Brc1ccc(cc1)C1C2=C(Nc3n1nnn3)CC(CC2=O)(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 C16H16BrN5O MW 374.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16BrN5O/c1-16(2)7-11-13(12(23)8-16)14(9-3-5-10(17)6-4-9)22-15(18-11)19-20-21-22/h3-6,14H,7-8H2,1-2H3,(H,18,19,21)InChIKey
ZMTVFALWDGQGHN-UHFFFAOYSA-NSynonyms
9(4bromophenyl)66dimethyl1579tetrahydrotetrazolo(51b)quinazolin8one
9(4bromophenyl)66dimethyl5679tetrahydrotetrazolo(51b)quinazolin8(4H)one
CC1(CC2=C(C(N3C(=N2)N=NN3)C4=CC=C(C=C4)Br)C(=O)C1)C
InChI=1SC16H16BrN5Oc116(2)71113(12(23)816)14(93510(17)649)2215(1811)19202122h3614H78H212H3(H181921)
MFCD10465683
ZINC000009260888
ZINC000009260890
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