Vitas-M small molecule compound
3-({[(4-ethyl-5-{1-[(furan-2-ylcarbonyl)amino]ethyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoic acid
Catalog ID
STK336232
SMILES CCn1c(SCC(=O)Nc2cccc(c2)C(=O)O)nnc1C(NC(=O)c1ccco1)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 C20H21N5O5S MW 443.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O5S/c1-3-25-17(12(2)21-18(27)15-8-5-9-30-15)23-24-20(25)31-11-16(26)22-14-7-4-6-13(10-14)19(28)29/h4-10,12H,3,11H2,1-2H3,(H,21,27)(H,22,26)(H,28,29)InChIKey
BQDPBNSMKGUZMB-UHFFFAOYSA-NSynonyms
3((((4ETHYL5(1((FURAN2YLCARBONYL)AMINO)ETHYL)4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOICACID
3((2((4ethyl5(1(furan2carbonylamino)ethyl)124triazol3yl)sulfanyl)acetyl)amino)benzoicacid
CCN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2)C(=O)O)C(C)NC(=O)C3=CC=CO3
InChI=1SC20H21N5O5Sc132517(12(2)2118(27)158593015)232420(25)311116(26)221474613(1014)19(28)29h41012H311H212H3(H2127)(H2226)(H2829)
MFCD09964603
ZINC000018201358
ZINC000018201360
Check stock
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