Vitas-M small molecule compound
N-(2-chloro-6-methylphenyl)-2-[(4-ethyl-5-{[(4-fluorophenyl)(methylsulfonyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Catalog ID
STL365649
SMILES CCn1c(SCC(=O)Nc2c(C)cccc2Cl)nnc1CN(S(=O)(=O)C)c1ccc(cc1)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 C21H23ClFN5O3S2 MW 512.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23ClFN5O3S2/c1-4-27-18(12-28(33(3,30)31)16-10-8-15(23)9-11-16)25-26-21(27)32-13-19(29)24-20-14(2)6-5-7-17(20)22/h5-11H,4,12-13H2,1-3H3,(H,24,29)InChIKey
XXRWDVXFJOLAAP-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=C(C=CC=C2Cl)C)CN(C3=CC=C(C=C3)F)S(=O)(=O)C
InChI=1SC21H23ClFN5O3S2c142718(1228(33(330)31)1610815(23)91116)252621(27)321319(29)242014(2)65717(20)22h511H41213H213H3(H2429)
MFCD27591662
N(2chloro6methylphenyl)2((4ethyl5(((4fluorophenyl)(methylsulfonyl)amino)methyl)4H124triazol3yl)sulfanyl)acetamide
N(2chloro6methylphenyl)2((4ethyl5((4fluoroNmethylsulfonylanilino)methyl)124triazol3yl)sulfanyl)acetamide
ZINC000020416248
ZINC20416248
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