Vitas-M small molecule compound

1-[3-(4-bromo-1H-pyrazol-1-yl)propyl]-3-(2-methoxy-4-nitrophenyl)urea

Catalog ID
STK461312
SMILES COc1cc(ccc1NC(=O)NCCCn1ncc(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 C14H16BrN5O4 MW 398.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16BrN5O4/c1-24-13-7-11(20(22)23)3-4-12(13)18-14(21)16-5-2-6-19-9-10(15)8-17-19/h3-4,7-9H,2,5-6H2,1H3,(H2,16,18,21)
InChIKey
BZUTUBGARQXCSJ-UHFFFAOYSA-N
Synonyms

((3(4BROMOPYRAZOLYL)PROPYL)AMINO)N(2METHOXY4NITROPHENYL)CARBOXAMIDE
1(3(4bromo1Hpyrazol1yl)propyl)3(2methoxy4nitrophenyl)urea
1(3(4BROMOPYRAZOL1YL)PROPYL)3(2METHOXY4NITROPHENYL)UREA
COC1=C(C=CC(=C1)(N+)(=O)(O))NC(=O)NCCCN2C=C(C=N2)Br
COc1cc(ccc1NC(=O)NCCCn1ncc(c1)Br)(N+)(=O)(O)
InChI=1SC14H16BrN5O4c12413711(20(22)23)3412(13)1814(21)1652619910(15)81719h3479H256H21H3(H2161821)
MFCD04136964
ZINC000005042023
ZINC05042023
ZINC5042023

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Available files

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