Vitas-M small molecule compound
9-(4-bromophenyl)-5,6,7,9-tetrahydrotetrazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK333544
SMILES Brc1ccc(cc1)C1C2=C(CCCC2=O)Nc2n1nnn2
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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 C14H12BrN5O MW 346.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12BrN5O/c15-9-6-4-8(5-7-9)13-12-10(2-1-3-11(12)21)16-14-17-18-19-20(13)14/h4-7,13H,1-3H2,(H,16,17,19)InChIKey
YASSNHLYVLABDL-UHFFFAOYSA-NSynonyms
9(4bromophenyl)5679tetrahydro1Htetrazolo(51b)quinazolin8one
9(4bromophenyl)5679tetrahydrotetrazolo(51b)quinazolin8(4H)one
C1CC2=C(C(N3C(=N2)N=NN3)C4=CC=C(C=C4)Br)C(=O)C1
InChI=1SC14H12BrN5Oc159648(579)131210(21311(12)21)161417181920(13)14h4713H13H2(H161719)
MFCD09963133
ZINC000018195991
ZINC000018195992
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