Vitas-M small molecule compound

{3,5-bis[(4-methoxybenzyl)amino]-1H-1,2,4-triazol-1-yl}(2-nitrophenyl)methanone

Catalog ID
STK169732
SMILES COc1ccc(cc1)CNc1nn(c(n1)NCc1ccc(cc1)OC)C(=O)c1ccccc1[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/c1-35-19-11-7-17(8-12-19)15-26-24-28-25(27-16-18-9-13-20(36-2)14-10-18)30(29-24)23(32)21-5-3-4-6-22(21)31(33)34/h3-14H,15-16H2,1-2H3,(H2,26,27,28,29)
InChIKey
SCPBBAIOEBILQW-UHFFFAOYSA-N
Synonyms

(35BIS((4METHOXYBENZYL)AMINO)1H124TRIAZOL1YL)(2NITROPHENYL)METHANONE
(35BIS((4METHOXYPHENYL)METHYLAMINO)124TRIAZOL1YL)(2NITROPHENYL)METHANONE
(35BIS(PANISYLAMINO)124TRIAZOL1YL)(2NITROPHENYL)METHANONE
COC1=CC=C(C=C1)CNC2=NN(C(=N2)NCC3=CC=C(C=C3)OC)C(=O)C4=CC=CC=C4(N+)(=O)(O)
COc1ccc(cc1)CNc1nn(c(n1)NCc1ccc(cc1)OC)C(=O)c1ccccc1(N+)(=O)(O)
InChI=1SC25H24N6O5c1351911717(81219)1526242825(27161891320(362)141018)30(2924)23(32)21534622(21)31(33)34h314H1516H212H3(H226272829)
MFCD06630090
NNBIS(4METHOXYBENZYL)1(2NITROBENZOYL)1H124TRIAZOLE35DIAMINE
ZINC000002884591
ZINC02884591
ZINC2884591

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Available files

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