Vitas-M small molecule compound
{[4-ethyl-5-(1-{[(2-fluorophenyl)carbonyl]amino}-2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
Catalog ID
STL182675
SMILES CCn1c(SCC(=O)O)nnc1C(C(C)C)NC(=O)c1ccccc1F
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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 C17H21FN4O3S MW 380.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21FN4O3S/c1-4-22-15(20-21-17(22)26-9-13(23)24)14(10(2)3)19-16(25)11-7-5-6-8-12(11)18/h5-8,10,14H,4,9H2,1-3H3,(H,19,25)(H,23,24)InChIKey
DRDAHRFSTCGDKF-UHFFFAOYSA-NSynonyms
((4ethyl5(1(((2fluorophenyl)carbonyl)amino)2methylpropyl)4H124triazol3yl)sulfanyl)aceticacid
2((4ethyl5(1((2fluorobenzoyl)amino)2methylpropyl)124triazol3yl)sulfanyl)aceticacid
CCN1C(=NN=C1SCC(=O)O)C(C(C)C)NC(=O)C2=CC=CC=C2F
InChI=1SC17H21FN4O3Sc142215(202117(22)26913(23)24)14(10(2)3)1916(25)11756812(11)18h581014H49H213H3(H1925)(H2324)
MFCD22385651
ZINC000072328141
ZINC000072328142
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