Vitas-M small molecule compound
N-(3,5-difluorophenyl)-2-[(4-methyl-5-{[(4-methylphenyl)(methylsulfonyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Catalog ID
STL365879
SMILES O=C(Nc1cc(F)cc(c1)F)CSc1nnc(n1C)CN(S(=O)(=O)C)c1ccc(cc1)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 C20H21F2N5O3S2 MW 481.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21F2N5O3S2/c1-13-4-6-17(7-5-13)27(32(3,29)30)11-18-24-25-20(26(18)2)31-12-19(28)23-16-9-14(21)8-15(22)10-16/h4-10H,11-12H2,1-3H3,(H,23,28)InChIKey
ULIYBVIWMMDGDR-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)N(CC2=NN=C(N2C)SCC(=O)NC3=CC(=CC(=C3)F)F)S(=O)(=O)C
InChI=1SC20H21F2N5O3S2c1134617(7513)27(32(329)30)1118242520(26(18)2)311219(28)2316914(21)815(22)1016h410H1112H213H3(H2328)
MFCD14833810
N(35difluorophenyl)2((4methyl5(((4methylphenyl)(methylsulfonyl)amino)methyl)4H124triazol3yl)sulfanyl)acetamide
N(35difluorophenyl)2((4methyl5((4methylNmethylsulfonylanilino)methyl)124triazol3yl)sulfanyl)acetamide
ZINC000015019664
ZINC15019664
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