Vitas-M small molecule compound
N-{4-[3-acetyl-5-{2-[(2-fluorobenzyl)oxy]phenyl}-1-(4-methylphenyl)-1,5-dihydro-4H-1,2,4-triazol-4-yl]-2-methoxyphenyl}-2-methylpropanamide
Catalog ID
STK513033
SMILES COc1cc(ccc1NC(=O)C(C)C)N1C(=NN(C1c1ccccc1OCc1ccccc1F)c1ccc(cc1)C)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 C35H35FN4O4 MW 594.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H35FN4O4/c1-22(2)34(42)37-30-19-18-27(20-32(30)43-5)39-33(24(4)41)38-40(26-16-14-23(3)15-17-26)35(39)28-11-7-9-13-31(28)44-21-25-10-6-8-12-29(25)36/h6-20,22,35H,21H2,1-5H3,(H,37,42)InChIKey
RFOHSDOXPMBXFU-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)N2C(N(C(=N2)C(=O)C)C3=CC(=C(C=C3)NC(=O)C(C)C)OC)C4=CC=CC=C4OCC5=CC=CC=C5F
InChI=1SC35H35FN4O4c122(2)34(42)3730191827(2032(30)435)3933(24(4)41)3840(26161423(3)151726)35(39)2811791331(28)44212510681229(25)36h6202235H21H215H3(H3742)
MFCD03863946
N(4(3acetyl5(2((2fluorobenzyl)oxy)phenyl)1(4methylphenyl)15dihydro4H124triazol4yl)2methoxyphenyl)2methylpropanamide
N(4(5ACETYL3(2((2FLUOROPHENYL)METHOXY)PHENYL)2(4METHYLPHENYL)3H124TRIAZOL4YL)2METHOXYPHENYL)2METHYLPROPANAMIDE
ZINC000002177867
ZINC000002177868
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