Vitas-M small molecule compound
4-({(Z)-[3-methyl-1-(4-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)butanoic acid
Catalog ID
STL359357
SMILES OC(=O)CCCN/C=C\1/C(=NN(C1=O)c1ccc(cc1)C)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 C16H19N3O3 MW 301.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N3O3/c1-11-5-7-13(8-6-11)19-16(22)14(12(2)18-19)10-17-9-3-4-15(20)21/h5-8,10,17H,3-4,9H2,1-2H3,(H,20,21)/b14-10-InChIKey
SXPLLAGPEVTYSN-UVTDQMKNSA-NSynonyms
4(((3METHYL1(4METHYLPHENYL)5OXO12DIAZOLIN4YLIDENE)METHYL)AMINO)BUTANOICACID
4(((Z)(3methyl1(4methylphenyl)5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)butanoicacid
4(((Z)(3METHYL1(4METHYLPHENYL)5OXOPYRAZOL4YLIDENE)METHYL)AMINO)BUTANOICACID
CC1=CC=C(C=C1)N2C(=O)C(=CNCCCC(=O)O)C(=N2)C
InChI=1SC16H19N3O3c1115713(8611)1916(22)14(12(2)1819)101793415(20)21h581017H349H212H3(H2021)b1410
MFCD01102373
OC(=O)CCCNC=C1C(=NN(C1=O)c1ccc(cc1)C)C
ZINC000035185254
ZINC35185254
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