Vitas-M small molecule compound
N-(2-{[(4-ethoxyphenyl)carbonyl]amino}ethyl)-3-{[2-(trifluoromethyl)-1H-benzimidazol-1-yl]methyl}-1,2,4-oxadiazole-5-carboxamide
Catalog ID
STK786107
SMILES CCOc1ccc(cc1)C(=O)NCCNC(=O)c1onc(n1)Cn1c2ccccc2nc1C(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 C23H21F3N6O4 MW 502.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21F3N6O4/c1-2-35-15-9-7-14(8-10-15)19(33)27-11-12-28-20(34)21-30-18(31-36-21)13-32-17-6-4-3-5-16(17)29-22(32)23(24,25)26/h3-10H,2,11-13H2,1H3,(H,27,33)(H,28,34)InChIKey
SKRIUHANCSOVGE-UHFFFAOYSA-NSynonyms
CCOC1=CC=C(C=C1)C(=O)NCCNC(=O)C2=NC(=NO2)CN3C4=CC=CC=C4N=C3C(F)(F)F
InChI=1SC23H21F3N6O4c1235159714(81015)19(33)2711122820(34)213018(313621)133217643516(17)2922(32)23(2425)26h310H21113H21H3(H2733)(H2834)
MFCD08094252
N(2(((4ethoxyphenyl)carbonyl)amino)ethyl)3((2(trifluoromethyl)1Hbenzimidazol1yl)methyl)124oxadiazole5carboxamide
N(2((4ethoxybenzoyl)amino)ethyl)3((2(trifluoromethyl)benzimidazol1yl)methyl)124oxadiazole5carboxamide
ZINC000012411717
ZINC12411717
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