Vitas-M small molecule compound
methyl 2-{[(3-nitro-1H-1,2,4-triazol-1-yl)acetyl]amino}benzoate
Catalog ID
STK343969
SMILES COC(=O)c1ccccc1NC(=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 C12H11N5O5 MW 305.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N5O5/c1-22-11(19)8-4-2-3-5-9(8)14-10(18)6-16-7-13-12(15-16)17(20)21/h2-5,7H,6H2,1H3,(H,14,18)InChIKey
JPBPUEHTGCHBIC-UHFFFAOYSA-NSynonyms
312635-49-72(2(3NITRO(124)TRIAZOL1YL)ACETYLAMINO)BENZOICACIDMETHYLESTER
312635497
COC(=O)C1=CC=CC=C1NC(=O)CN2C=NC(=N2)(N+)(=O)(O)
COC(=O)c1ccccc1NC(=O)Cn1cnc(n1)(N+)(=O)(O)
InChI=1SC12H11N5O5c12211(19)842359(8)1410(18)61671312(1516)17(20)21h257H6H21H3(H1418)
METHYL2(((3NITRO1H124TRIAZOL1YL)ACETYL)AMINO)BENZOATE
METHYL2((2(3NITRO124TRIAZOL1YL)ACETYL)AMINO)BENZOATE
METHYL2(2(3NITRO124TRIAZOLYL)ACETYLAMINO)BENZOATE
methyl2(2(3nitro1H124triazol1yl)acetamido)benzoate
ZINC00216964
ZINC216964
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