Vitas-M small molecule compound
{[5-{[(furan-2-ylcarbonyl)amino]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
Catalog ID
STL182643
SMILES C=CCn1c(CNC(=O)c2ccco2)nnc1SCC(=O)O
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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 C13H14N4O4S MW 322.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N4O4S/c1-2-5-17-10(15-16-13(17)22-8-11(18)19)7-14-12(20)9-4-3-6-21-9/h2-4,6H,1,5,7-8H2,(H,14,20)(H,18,19)InChIKey
DZZFWGBRXCYPHY-UHFFFAOYSA-NSynonyms
((5(((furan2ylcarbonyl)amino)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)aceticacid
2((5((furan2carbonylamino)methyl)4prop2enyl124triazol3yl)sulfanyl)aceticacid
C=CCN1C(=NN=C1SCC(=O)O)CNC(=O)C2=CC=CO2
InChI=1SC13H14N4O4Sc1251710(151613(17)22811(18)19)71412(20)9436219h246H1578H2(H1420)(H1819)
MFCD22385624
ZINC000072328106
ZINC72328106
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