Vitas-M small molecule compound
N-{[4-ethyl-5-({2-[(4-iodophenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}-4-fluorobenzamide
Catalog ID
STL122245
SMILES CCn1c(SCC(=O)Nc2ccc(cc2)I)nnc1CNC(=O)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 C20H19FIN5O2S MW 539.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19FIN5O2S/c1-2-27-17(11-23-19(29)13-3-5-14(21)6-4-13)25-26-20(27)30-12-18(28)24-16-9-7-15(22)8-10-16/h3-10H,2,11-12H2,1H3,(H,23,29)(H,24,28)InChIKey
RZZORHVASCSGPF-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)I)CNC(=O)C3=CC=C(C=C3)F
InChI=1SC20H19FIN5O2Sc122717(112319(29)133514(21)6413)252620(27)301218(28)24169715(22)81016h310H21112H21H3(H2329)(H2428)
MFCD04393369
N((4ethyl5((2((4iodophenyl)amino)2oxoethyl)sulfanyl)4H124triazol3yl)methyl)4fluorobenzamide
N((4ETHYL5(2(4IODOANILINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)METHYL)4FLUOROBENZAMIDE
ZINC000059603597
ZINC59603597
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