Vitas-M small molecule compound
ethyl 5-(4-methylphenyl)-1-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1H-1,2,3-triazole-4-carboxylate
Catalog ID
STK773495
SMILES CCOC(=O)c1nnn(c1c1ccc(cc1)C)c1nonc1n1cccc1
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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 C18H16N6O3 MW 364.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N6O3/c1-3-26-18(25)14-15(13-8-6-12(2)7-9-13)24(22-19-14)17-16(20-27-21-17)23-10-4-5-11-23/h4-11H,3H2,1-2H3InChIKey
DGMCMMWMQVSSRA-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(N=N1)C2=NON=C2N3C=CC=C3)C4=CC=C(C=C4)C
ethyl5(4methylphenyl)1(4(1Hpyrrol1yl)125oxadiazol3yl)1H123triazole4carboxylate
ETHYL5(4METHYLPHENYL)1(4PYRROL1YL125OXADIAZOL3YL)TRIAZOLE4CARBOXYLATE
InChI=1SC18H16N6O3c132618(25)1415(138612(2)7913)24(221914)1716(20272117)2310451123h411H3H212H3
MFCD03854973
ZINC000001080479
ZINC01080479
ZINC1080479
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