Vitas-M small molecule compound
N-[4-(4-methyl-4H-1,2,4-triazol-3-yl)phenyl]-3,5-dinitrobenzamide
Catalog ID
STK381942
SMILES O=C(c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])Nc1ccc(cc1)c1nncn1C
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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 C16H12N6O5 MW 368.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N6O5/c1-20-9-17-19-15(20)10-2-4-12(5-3-10)18-16(23)11-6-13(21(24)25)8-14(7-11)22(26)27/h2-9H,1H3,(H,18,23)InChIKey
UEXQABHOWGDRNQ-UHFFFAOYSA-NSynonyms
(35DINITROPHENYL)N(4(4METHYL(124TRIAZOL3YL))PHENYL)CARBOXAMIDE
CN1C=NN=C1C2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC16H12N6O5c1209171915(20)102412(5310)1816(23)11613(21(24)25)814(711)22(26)27h29H1H3(H1823)
MFCD02915370
N(4(4METHYL124TRIAZOL3YL)PHENYL)35DINITROBENZAMIDE
N(4(4methyl4H124triazol3yl)phenyl)35dinitrobenzamide
O=C(c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O))Nc1ccc(cc1)c1nncn1C
ZINC000008722290
ZINC08722290
ZINC8722290
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