Vitas-M small molecule compound

7-(2,4-dimethylphenyl)-3-(4-nitrophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine

Catalog ID
STL151224
SMILES Cc1ccc(c(c1)C)n1ncc2c1ncn1c2nnc1c1ccc(cc1)[N+](=O)[O-]

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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 C20H15N7O2 MW 385.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15N7O2/c1-12-3-8-17(13(2)9-12)26-19-16(10-22-26)20-24-23-18(25(20)11-21-19)14-4-6-15(7-5-14)27(28)29/h3-11H,1-2H3
InChIKey
OKHUTXGNTUNUHG-UHFFFAOYSA-N
Synonyms
713086-65-8
7(24DIMETHYLPHENYL)3(4NITROPHENYL)7HPYRAZOLO(43E)(124)TRIAZOLO(43C)PYRIMIDINE
713086658
CC1=CC(=C(C=C1)N2C3=C(C=N2)C4=NN=C(N4C=N3)C5=CC=C(C=C5)(N+)(=O)(O))C
Cc1ccc(c(c1)C)n1ncc2c1ncn1c2nnc1c1ccc(cc1)(N+)(=O)(O)
InChI=1SC20H15N7O2c1123817(13(2)912)261916(102226)20242318(25(20)112119)144615(7514)27(28)29h311H12H3
MFCD04196553
ZINC000005255180
ZINC05255180
ZINC5255180

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Available files

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