Vitas-M small molecule compound
4-[(4Z)-4-benzylidene-5-oxo-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid
Catalog ID
STK398244
SMILES O=C1N(N=C(/C/1=C/c1ccccc1)c1ccccc1)c1ccc(cc1)C(=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 C23H16N2O3 MW 368.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16N2O3/c26-22-20(15-16-7-3-1-4-8-16)21(17-9-5-2-6-10-17)24-25(22)19-13-11-18(12-14-19)23(27)28/h1-15H,(H,27,28)/b20-15-InChIKey
YZGAFDMUVGWMMN-HKWRFOASSA-NSynonyms
486994-80-34((4Z)4benzylidene5oxo3phenyl45dihydro1Hpyrazol1yl)benzoicacid
4((4Z)4BENZYLIDENE5OXO3PHENYLPYRAZOL1YL)BENZOICACID
4(4BENZYLIDENE5OXO3PHENYL45DIHYDRO1HPYRAZOL1YL)BENZOICACID
486994803
C1=CC=C(C=C1)C=C2C(=NN(C2=O)C3=CC=C(C=C3)C(=O)O)C4=CC=CC=C4
InChI=1SC23H16N2O3c262220(15167314816)21(1795261017)2425(22)19131118(121419)23(27)28h115H(H2728)b2015
MFCD02952137
O=C1N(N=C(C1=Cc1ccccc1)c1ccccc1)c1ccc(cc1)C(=O)O
ZINC000004660184
ZINC4660184
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