Vitas-M small molecule compound
3-nitro-N-{1-[3-(trifluoromethyl)benzyl]-1H-1,2,4-triazol-3-yl}benzamide
Catalog ID
STL176811
SMILES O=C(c1cccc(c1)[N+](=O)[O-])Nc1ncn(n1)Cc1cccc(c1)C(F)(F)F
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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 C17H12F3N5O3 MW 391.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12F3N5O3/c18-17(19,20)13-5-1-3-11(7-13)9-24-10-21-16(23-24)22-15(26)12-4-2-6-14(8-12)25(27)28/h1-8,10H,9H2,(H,22,23,26)InChIKey
ULKGOIKQPHIEEF-UHFFFAOYSA-NSynonyms
761403-18-33NITRON(1((3(TRIFLUOROMETHYL)PHENYL)METHYL)124TRIAZOL3YL)BENZAMIDE
3nitroN(1(3(trifluoromethyl)benzyl)1H124triazol3yl)benzamide
761403183
C1=CC(=CC(=C1)C(F)(F)F)CN2C=NC(=N2)NC(=O)C3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC17H12F3N5O3c1817(1920)1351311(713)924102116(2324)2215(26)1242614(812)25(27)28h1810H9H2(H222326)
MFCD04131387
O=C(c1cccc(c1)(N+)(=O)(O))Nc1ncn(n1)Cc1cccc(c1)C(F)(F)F
ZINC000002794626
ZINC02794626
ZINC2794626
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