Vitas-M small molecule compound
{3-(furan-2-yl)-5-[(3-nitrobenzyl)amino]-1H-1,2,4-triazol-1-yl}(2-methoxyphenyl)methanone
Catalog ID
STK246600
SMILES COc1ccccc1C(=O)n1nc(nc1NCc1cccc(c1)[N+](=O)[O-])c1ccco1
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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 C21H17N5O5 MW 419.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N5O5/c1-30-17-9-3-2-8-16(17)20(27)25-21(23-19(24-25)18-10-5-11-31-18)22-13-14-6-4-7-15(12-14)26(28)29/h2-12H,13H2,1H3,(H,22,23,24)InChIKey
ITLNCMAGWNHYEB-UHFFFAOYSA-NSynonyms
(3(furan2yl)5((3nitrobenzyl)amino)1H124triazol1yl)(2methoxyphenyl)methanone
(3(furan2yl)5((3nitrophenyl)methylamino)124triazol1yl)(2methoxyphenyl)methanone
COC1=CC=CC=C1C(=O)N2C(=NC(=N2)C3=CC=CO3)NCC4=CC(=CC=C4)(N+)(=O)(O)
COc1ccccc1C(=O)n1nc(nc1NCc1cccc(c1)(N+)(=O)(O))c1ccco1
InChI=1SC21H17N5O5c13017932816(17)20(27)2521(2319(2425)18105113118)22131464715(1214)26(28)29h212H13H21H3(H222324)
MFCD08685214
ZINC000009667703
ZINC09667703
ZINC9667703
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