Vitas-M small molecule compound
ethyl 5-{[(3,5-dinitrophenyl)carbonyl]amino}-1-phenyl-1H-pyrazole-4-carboxylate
Catalog ID
STK753803
SMILES CCOC(=O)c1cnn(c1NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])c1ccccc1
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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 C19H15N5O7 MW 425.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N5O7/c1-2-31-19(26)16-11-20-22(13-6-4-3-5-7-13)17(16)21-18(25)12-8-14(23(27)28)10-15(9-12)24(29)30/h3-11H,2H2,1H3,(H,21,25)InChIKey
KQVDQCUKLHATLV-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)C3=CC(=CC(=C3)(N+)(=O)(O))(N+)(=O)(O)
CCOC(=O)c1cnn(c1NC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O))c1ccccc1
ethyl5(((35dinitrophenyl)carbonyl)amino)1phenyl1Hpyrazole4carboxylate
ETHYL5((35BISNITROBENZOYL)AMINO)1PHENYL1HPYRAZOLE4CARBOXYLATE
ETHYL5((35DINITROBENZOYL)AMINO)1PHENYL1HPYRAZOLE4CARBOXYLATE
ETHYL5((35DINITROBENZOYL)AMINO)1PHENYLPYRAZOLE4CARBOXYLATE
InChI=1SC19H15N5O7c123119(26)16112022(136435713)17(16)2118(25)12814(23(27)28)1015(912)24(29)30h311H2H21H3(H2125)
MFCD00783316
ZINC000002187631
ZINC02187631
ZINC2187631
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