Vitas-M small molecule compound

N-[3-(4-ethoxyphenoxy)-5-(3-methylphenoxy)phenyl]-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide

Catalog ID
STK342826
SMILES CCOc1ccc(cc1)Oc1cc(cc(c1)Oc1cccc(c1)C)NC(=O)Cn1cnc(n1)[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 C25H23N5O6 MW 489.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5O6/c1-3-34-19-7-9-20(10-8-19)35-22-12-18(13-23(14-22)36-21-6-4-5-17(2)11-21)27-24(31)15-29-16-26-25(28-29)30(32)33/h4-14,16H,3,15H2,1-2H3,(H,27,31)
InChIKey
LWUYUJIOIUFKRZ-UHFFFAOYSA-N
Synonyms
313387-49-4
313387494
CCOC1=CC=C(C=C1)OC2=CC(=CC(=C2)NC(=O)CN3C=NC(=N3)(N+)(=O)(O))OC4=CC=CC(=C4)C
CCOc1ccc(cc1)Oc1cc(cc(c1)Oc1cccc(c1)C)NC(=O)Cn1cnc(n1)(N+)(=O)(O)
InChI=1SC25H23N5O6c1334197920(10819)35221218(1323(1422)362164517(2)1121)2724(31)1529162625(2829)30(32)33h41416H315H212H3(H2731)
MFCD01027036
N(3(4ETHOXYPHENOXY)5(3METHYLPHENOXY)PHENYL)2(3NITRO(124TRIAZOLYL))ACETAMIDE
N(3(4ETHOXYPHENOXY)5(3METHYLPHENOXY)PHENYL)2(3NITRO124TRIAZOL1YL)ACETAMIDE
N(3(4ETHOXYPHENOXY)5(3METHYLPHENOXY)PHENYL)2(3NITRO1H124TRIAZOL1YL)ACETAMIDE
N(3(4ethoxyphenoxy)5(mtolyloxy)phenyl)2(3nitro1H124triazol1yl)acetamide
ZINC000000799076
ZINC00799076
ZINC799076

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.