Vitas-M small molecule compound
4-[({5-methyl-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazol-4-yl}carbonyl)amino]benzoic acid
Catalog ID
STL022845
SMILES O=C(c1nnn(c1C)c1cccc(c1)C(F)(F)F)Nc1ccc(cc1)C(=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 C18H13F3N4O3 MW 390.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13F3N4O3/c1-10-15(16(26)22-13-7-5-11(6-8-13)17(27)28)23-24-25(10)14-4-2-3-12(9-14)18(19,20)21/h2-9H,1H3,(H,22,26)(H,27,28)InChIKey
OYMVAANXESGYDB-UHFFFAOYSA-NSynonyms
892317-42-94(((5methyl1(3(trifluoromethyl)phenyl)1H123triazol4yl)carbonyl)amino)benzoicacid
4((5METHYL1(3(TRIFLUOROMETHYL)PHENYL)123TRIAZOL4YL)CARBONYLAMINO)BENZOICACID
4((5METHYL1(3(TRIFLUOROMETHYL)PHENYL)TRIAZOLE4CARBONYL)AMINO)BENZOICACID
4(5METHYL1(3(TRIFLUOROMETHYL)PHENYL)1H123TRIAZOLE4CARBOXAMIDO)BENZOICACID
892317429
CC1=C(N=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)NC3=CC=C(C=C3)C(=O)O
InChI=1SC18H13F3N4O3c11015(16(26)22137511(6813)17(27)28)232425(10)1442312(914)18(1920)21h29H1H3(H2226)(H2728)
MFCD07802361
ZINC000005033390
ZINC5033390
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