Vitas-M small molecule compound
9-(4-hydroxy-3-methoxy-5-nitrophenyl)-5,6,7,9-tetrahydrotetrazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK333554
SMILES COc1cc(cc(c1O)[N+](=O)[O-])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 C15H14N6O5 MW 358.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N6O5/c1-26-11-6-7(5-9(14(11)23)21(24)25)13-12-8(3-2-4-10(12)22)16-15-17-18-19-20(13)15/h5-6,13,23H,2-4H2,1H3,(H,16,17,19)InChIKey
CHPXGLFRUDMSLT-UHFFFAOYSA-NSynonyms
9(4hydroxy3methoxy5nitrophenyl)5679tetrahydro1Htetrazolo(51b)quinazolin8one
9(4hydroxy3methoxy5nitrophenyl)5679tetrahydrotetrazolo(51b)quinazolin8(4H)one
COC1=CC(=CC(=C1O)(N+)(=O)(O))C2C3=C(CCCC3=O)N=C4N2NN=N4
COc1cc(cc(c1O)(N+)(=O)(O))C1C2=C(CCCC2=O)Nc2n1nnn2
InChI=1SC15H14N6O5c1261167(59(14(11)23)21(24)25)13128(32410(12)22)161517181920(13)15h561323H24H21H3(H161719)
MFCD09963140
ZINC000018196005
ZINC000018196007
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