Vitas-M small molecule compound
propyl 4-[({3-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]phenyl}carbonyl)amino]benzoate
Catalog ID
STK967719
SMILES CCCOC(=O)c1ccc(cc1)NC(=O)c1cccc(c1)Cn1nc(c(c1)Br)[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 C21H19BrN4O5 MW 487.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN4O5/c1-2-10-31-21(28)15-6-8-17(9-7-15)23-20(27)16-5-3-4-14(11-16)12-25-13-18(22)19(24-25)26(29)30/h3-9,11,13H,2,10,12H2,1H3,(H,23,27)InChIKey
UAFYWWLSSPCDQQ-UHFFFAOYSA-NSynonyms
491829-84-6491829846
CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)CN3C=C(C(=N3)(N+)(=O)(O))Br
CCCOC(=O)c1ccc(cc1)NC(=O)c1cccc(c1)Cn1nc(c(c1)Br)(N+)(=O)(O)
InChI=1SC21H19BrN4O5c12103121(28)156817(9715)2320(27)1653414(1116)12251318(22)19(2425)26(29)30h391113H21012H21H3(H2327)
MFCD03071505
propyl4(((3((4bromo3nitro1Hpyrazol1yl)methyl)phenyl)carbonyl)amino)benzoate
PROPYL4((3((4BROMO3NITROPYRAZOL1YL)METHYL)BENZOYL)AMINO)BENZOATE
ZINC000002761329
ZINC02761329
ZINC2761329
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