Vitas-M small molecule compound
4-(4-{[(4-methyl-3-nitrophenyl)carbonyl]amino}-1H-pyrazol-1-yl)butanoic acid
Catalog ID
STK684635
SMILES OC(=O)CCCn1ncc(c1)NC(=O)c1ccc(c(c1)[N+](=O)[O-])C
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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 C15H16N4O5 MW 332.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N4O5/c1-10-4-5-11(7-13(10)19(23)24)15(22)17-12-8-16-18(9-12)6-2-3-14(20)21/h4-5,7-9H,2-3,6H2,1H3,(H,17,22)(H,20,21)InChIKey
MNUVZOIBRKECTA-UHFFFAOYSA-NSynonyms
4(4(((4methyl3nitrophenyl)carbonyl)amino)1Hpyrazol1yl)butanoicacid
4(4((4METHYL3NITROBENZOYL)AMINO)PYRAZOL1YL)BUTANOICACID
CC1=C(C=C(C=C1)C(=O)NC2=CN(N=C2)CCCC(=O)O)(N+)(=O)(O)
InChI=1SC15H16N4O5c1104511(713(10)19(23)24)15(22)171281618(912)62314(20)21h4579H236H21H3(H1722)(H2021)
MFCD05855542
OC(=O)CCCn1ncc(c1)NC(=O)c1ccc(c(c1)(N+)(=O)(O))C
ZINC000004628800
ZINC4628800
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