Vitas-M small molecule compound
6-methoxy-3-(5-phenyl-4H-1,2,4-triazol-3-yl)-2H-chromen-2-one
Catalog ID
STL328117
SMILES COc1ccc2c(c1)cc(c(=O)o2)c1nnc([nH]1)c1ccccc1
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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 C18H13N3O3 MW 319.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N3O3/c1-23-13-7-8-15-12(9-13)10-14(18(22)24-15)17-19-16(20-21-17)11-5-3-2-4-6-11/h2-10H,1H3,(H,19,20,21)InChIKey
ZVNHWGUPSPGNBO-UHFFFAOYSA-NSynonyms
6METHOXY3(3PHENYL1H124TRIAZOL5YL)CHROMEN2ONE
6METHOXY3(5PHENYL(4H124TRIAZOL3YL))CHROMEN2ONE
6methoxy3(5phenyl4H124triazol3yl)2Hchromen2one
COC1=CC2=C(C=C1)OC(=O)C(=C2)C3=NC(=NN3)C4=CC=CC=C4
COc1ccc2c(c1)cc(c(=O)o2)c1nnc((nH)1)c1ccccc1
InChI=1SC18H13N3O3c12313781512(913)1014(18(22)2415)171916(202117)115324611h210H1H3(H192021)
MFCD01246926
ZINC000005911261
ZINC05911261
ZINC5911261
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