Vitas-M small molecule compound
N-(2,6-dimethylphenyl)-1-{2-[(4-fluorobenzyl)amino]-2-oxoethyl}-5-methyl-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL143073
SMILES O=C(Cn1nnc(c1C)C(=O)Nc1c(C)cccc1C)NCc1ccc(cc1)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 C21H22FN5O2 MW 395.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22FN5O2/c1-13-5-4-6-14(2)19(13)24-21(29)20-15(3)27(26-25-20)12-18(28)23-11-16-7-9-17(22)10-8-16/h4-10H,11-12H2,1-3H3,(H,23,28)(H,24,29)InChIKey
NRKGDIMCJTVMCJ-UHFFFAOYSA-NSynonyms
CC1=C(C(=CC=C1)C)NC(=O)C2=C(N(N=N2)CC(=O)NCC3=CC=C(C=C3)F)C
InChI=1SC21H22FN5O2c11354614(2)19(13)2421(29)2015(3)27(262520)1218(28)2311167917(22)10816h410H1112H213H3(H2328)(H2429)
MFCD20747965
N(26dimethylphenyl)1(2((4fluorobenzyl)amino)2oxoethyl)5methyl1H123triazole4carboxamide
N(26dimethylphenyl)1(2((4fluorophenyl)methylamino)2oxoethyl)5methyltriazole4carboxamide
ZINC000071327414
ZINC71327414
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