Vitas-M small molecule compound
ethyl 1-[1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-1H-1,2,3-triazole-4-carboxylate
Catalog ID
STL370359
SMILES CCOC(=O)c1nnn(c1)C1CC(=O)N(C1=O)c1cccc(c1)Cl
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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 C15H13ClN4O4 MW 348.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13ClN4O4/c1-2-24-15(23)11-8-19(18-17-11)12-7-13(21)20(14(12)22)10-5-3-4-9(16)6-10/h3-6,8,12H,2,7H2,1H3InChIKey
BYYWYGFOATZUJJ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CN(N=N1)C2CC(=O)N(C2=O)C3=CC(=CC=C3)Cl
ethyl1(1(3chlorophenyl)25dioxopyrrolidin3yl)1H123triazole4carboxylate
ethyl1(1(3chlorophenyl)25dioxopyrrolidin3yl)triazole4carboxylate
InChI=1SC15H13ClN4O4c122415(23)11819(181711)12713(21)20(14(12)22)105349(16)610h36812H27H21H3
MFCD28952251
ZINC000098086527
ZINC000105969354
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