Vitas-M small molecule compound
1-{2-[(3-acetylphenyl)amino]-2-oxoethyl}-5-methyl-N-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL129806
SMILES O=C(Cn1nnc(c1C)C(=O)Nc1cccc(c1)C(F)(F)F)Nc1cccc(c1)C(=O)C
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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 C21H18F3N5O3 MW 445.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18F3N5O3/c1-12-19(20(32)26-17-8-4-6-15(10-17)21(22,23)24)27-28-29(12)11-18(31)25-16-7-3-5-14(9-16)13(2)30/h3-10H,11H2,1-2H3,(H,25,31)(H,26,32)InChIKey
GVCCSDWRGADPKL-UHFFFAOYSA-NSynonyms
1(2((3acetylphenyl)amino)2oxoethyl)5methylN(3(trifluoromethyl)phenyl)1H123triazole4carboxamide
1(2(3acetylanilino)2oxoethyl)5methylN(3(trifluoromethyl)phenyl)triazole4carboxamide
CC1=C(N=NN1CC(=O)NC2=CC=CC(=C2)C(=O)C)C(=O)NC3=CC=CC(=C3)C(F)(F)F
InChI=1SC21H18F3N5O3c11219(20(32)261784615(1017)21(2223)24)272829(12)1118(31)251673514(916)13(2)30h310H11H212H3(H2531)(H2632)
MFCD20747881
ZINC000067323006
ZINC67323006
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