Vitas-M small molecule compound

4-(4-{[(2-nitrophenyl)carbonyl]amino}-1H-pyrazol-1-yl)butanoic acid

Catalog ID
STK492951
SMILES OC(=O)CCCn1ncc(c1)NC(=O)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 C14H14N4O5 MW 318.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N4O5/c19-13(20)6-3-7-17-9-10(8-15-17)16-14(21)11-4-1-2-5-12(11)18(22)23/h1-2,4-5,8-9H,3,6-7H2,(H,16,21)(H,19,20)
InChIKey
VODOBAFOMBBGLJ-UHFFFAOYSA-N
Synonyms
955965-04-5
4(4(((2nitrophenyl)carbonyl)amino)1Hpyrazol1yl)butanoicacid
4(4((2NITROBENZOYL)AMINO)1HPYRAZOL1YL)BUTANOICACID
4(4((2NITROBENZOYL)AMINO)PYRAZOL1YL)BUTANOICACID
4(4((2NITROPHENYL)CARBONYLAMINO)PYRAZOLYL)BUTANOICACID
955965045
C1=CC=C(C(=C1)C(=O)NC2=CN(N=C2)CCCC(=O)O)(N+)(=O)(O)
InChI=1SC14H14N4O5c1913(20)63717910(81517)1614(21)11412512(11)18(22)23h124589H367H2(H1621)(H1920)
MFCD05260282
OC(=O)CCCn1ncc(c1)NC(=O)c1ccccc1(N+)(=O)(O)
ZINC000004693764
ZINC4693764

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Available files

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