Vitas-M small molecule compound
9-(4-hydroxy-3-methoxy-5-nitrophenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK333504
SMILES COc1cc(cc(c1O)[N+](=O)[O-])C1C2=C(CCCC2=O)Nc2n1ncn2
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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 C16H15N5O5 MW 357.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N5O5/c1-26-12-6-8(5-10(15(12)23)21(24)25)14-13-9(3-2-4-11(13)22)19-16-17-7-18-20(14)16/h5-7,14,23H,2-4H2,1H3,(H,17,18,19)InChIKey
RGECQYIYBNSVNO-UHFFFAOYSA-NSynonyms
9(4hydroxy3methoxy5nitrophenyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(4hydroxy3methoxy5nitrophenyl)5679tetrahydro1H(124)triazolo(51b)quinazolin8one
COC1=CC(=CC(=C1O)(N+)(=O)(O))C2C3=C(CCCC3=O)N=C4N2NC=N4
COc1cc(cc(c1O)(N+)(=O)(O))C1C2=C(CCCC2=O)Nc2n1ncn2
InChI=1SC16H15N5O5c1261268(510(15(12)23)21(24)25)14139(32411(13)22)19161771820(14)16h571423H24H21H3(H171819)
MFCD09963111
ZINC000018195928
ZINC000018195929
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