Vitas-M small molecule compound
{3,5-bis[(2-methoxybenzyl)amino]-1H-1,2,4-triazol-1-yl}(3-nitrophenyl)methanone
Catalog ID
STK169767
SMILES COc1ccccc1CNc1nn(c(n1)NCc1ccccc1OC)C(=O)c1cccc(c1)[N+](=O)[O-]
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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 C25H24N6O5 MW 488.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N6O5/c1-35-21-12-5-3-8-18(21)15-26-24-28-25(27-16-19-9-4-6-13-22(19)36-2)30(29-24)23(32)17-10-7-11-20(14-17)31(33)34/h3-14H,15-16H2,1-2H3,(H2,26,27,28,29)InChIKey
XPLDPBGTJAKTEE-UHFFFAOYSA-NSynonyms
(35BIS((2METHOXYBENZYL)AMINO)1H124TRIAZOL1YL)(3NITROPHENYL)METHANONE
(35bis((2methoxyphenyl)methylamino)124triazol1yl)(3nitrophenyl)methanone
COC1=CC=CC=C1CNC2=NN(C(=N2)NCC3=CC=CC=C3OC)C(=O)C4=CC(=CC=C4)(N+)(=O)(O)
COc1ccccc1CNc1nn(c(n1)NCc1ccccc1OC)C(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC25H24N6O5c135211253818(21)1526242825(2716199461322(19)362)30(2924)23(32)171071120(1417)31(33)34h314H1516H212H3(H226272829)
MFCD06663309
ZINC000009847065
ZINC09847065
ZINC9847065
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