Vitas-M small molecule compound
2-({5-[(2,5-dimethylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-fluorophenyl)acetamide
Catalog ID
STK400783
SMILES O=C(Nc1ccc(cc1)F)CSc1nnc(n1C)COc1cc(C)ccc1C
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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 C20H21FN4O2S MW 400.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21FN4O2S/c1-13-4-5-14(2)17(10-13)27-11-18-23-24-20(25(18)3)28-12-19(26)22-16-8-6-15(21)7-9-16/h4-10H,11-12H2,1-3H3,(H,22,26)InChIKey
FXCCDXZXHLSKIX-UHFFFAOYSA-NSynonyms
2((5((25dimethylphenoxy)methyl)4methyl124triazol3yl)sulfanyl)N(4fluorophenyl)acetamide
2((5((25dimethylphenoxy)methyl)4methyl4H124triazol3yl)sulfanyl)N(4fluorophenyl)acetamide
2(5((25DIMETHYLPHENOXY)METHYL)4METHYL(124TRIAZOL3YLTHIO))N(4FLUOROPHENYL)ACETAMIDE
CC1=CC(=C(C=C1)C)OCC2=NN=C(N2C)SCC(=O)NC3=CC=C(C=C3)F
InChI=1SC20H21FN4O2Sc1134514(2)17(1013)271118232420(25(18)3)281219(26)22168615(21)7916h410H1112H213H3(H2226)
MFCD07034949
ZINC000017081885
ZINC17081885
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