Vitas-M small molecule compound

N-[(4-methylbenzyl)oxy]-4-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]benzamide

Catalog ID
STK308535
SMILES Cc1ccc(cc1)CONC(=O)c1ccc(cc1)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 C18H17N5O4 MW 367.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N5O4/c1-13-2-4-15(5-3-13)11-27-21-17(24)16-8-6-14(7-9-16)10-22-12-19-18(20-22)23(25)26/h2-9,12H,10-11H2,1H3,(H,21,24)
InChIKey
UPVFDRIZSGJFHB-UHFFFAOYSA-N
Synonyms
678549-02-5
678549025
CC1=CC=C(C=C1)CONC(=O)C2=CC=C(C=C2)CN3C=NC(=N3)(N+)(=O)(O)
Cc1ccc(cc1)CONC(=O)c1ccc(cc1)Cn1cnc(n1)(N+)(=O)(O)
InChI=1SC18H17N5O4c1132415(5313)11272117(24)168614(7916)1022121918(2022)23(25)26h2912H1011H21H3(H2124)
MFCD04046883
N((4methylbenzyl)oxy)4((3nitro1H124triazol1yl)methyl)benzamide
N((4METHYLPHENYL)METHOXY)4((3NITRO124TRIAZOL1YL)METHYL)BENZAMIDE
ZINC000002797028
ZINC02797028
ZINC2797028

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Available files

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