Vitas-M small molecule compound

1-butyl-3-(2'-nitrobiphenyl-4-yl)urea

Catalog ID
STK450491
SMILES CCCCNC(=O)Nc1ccc(cc1)c1ccccc1[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 C17H19N3O3 MW 313.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O3/c1-2-3-12-18-17(21)19-14-10-8-13(9-11-14)15-6-4-5-7-16(15)20(22)23/h4-11H,2-3,12H2,1H3,(H2,18,19,21)
InChIKey
IJBJKGHKZQDLCN-UHFFFAOYSA-N
Synonyms

1butyl3(2nitrobiphenyl4yl)urea
1BUTYL3(4(2NITROPHENYL)PHENYL)UREA
CCCCNC(=O)NC1=CC=C(C=C1)C2=CC=CC=C2(N+)(=O)(O)
CCCCNC(=O)Nc1ccc(cc1)c1ccccc1(N+)(=O)(O)
InChI=1SC17H19N3O3c123121817(21)191410813(91114)15645716(15)20(22)23h411H2312H21H3(H2181921)
MFCD03758594
NBUTYL((4(2NITROPHENYL)PHENYL)AMINO)CARBOXAMIDE
ZINC000002764235
ZINC02764235
ZINC2764235

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Available files

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