Vitas-M small molecule compound
1-{3,5-bis[(2-chloro-6-fluorobenzyl)amino]-1H-1,2,4-triazol-1-yl}-2-methoxyethanone
Catalog ID
STK179036
SMILES COCC(=O)n1nc(nc1NCc1c(F)cccc1Cl)NCc1c(F)cccc1Cl
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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 C19H17Cl2F2N5O2 MW 456.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17Cl2F2N5O2/c1-30-10-17(29)28-19(25-9-12-14(21)5-3-7-16(12)23)26-18(27-28)24-8-11-13(20)4-2-6-15(11)22/h2-7H,8-10H2,1H3,(H2,24,25,26,27)InChIKey
IHXCVJJLYKVHMG-UHFFFAOYSA-NSynonyms
1(35BIS((2CHLORO6FLUOROBENZYL)AMINO)1H124TRIAZOL1YL)2METHOXYETHANONE
1(35bis((2chloro6fluorophenyl)methylamino)124triazol1yl)2methoxyethanone
COCC(=O)N1C(=NC(=N1)NCC2=C(C=CC=C2Cl)F)NCC3=C(C=CC=C3Cl)F
InChI=1SC19H17Cl2F2N5O2c1301017(29)2819(2591214(21)53716(12)23)2618(2728)2481113(20)42615(11)22h27H810H21H3(H224252627)
MFCD06664091
ZINC000009948695
ZINC09948695
ZINC9948695
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