Vitas-M small molecule compound
dimethyl 2-({(Z)-[1-(4-fluorophenyl)-5-oxo-3-propyl-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzene-1,4-dicarboxylate
Catalog ID
STK766684
SMILES CCCC1=NN(C(=O)/C/1=C\Nc1cc(ccc1C(=O)OC)C(=O)OC)c1ccc(cc1)F
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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 C23H22FN3O5 MW 439.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22FN3O5/c1-4-5-19-18(21(28)27(26-19)16-9-7-15(24)8-10-16)13-25-20-12-14(22(29)31-2)6-11-17(20)23(30)32-3/h6-13,25H,4-5H2,1-3H3/b18-13-InChIKey
MFTLCJKAKABOPQ-AQTBWJFISA-NSynonyms
CCCC1=NN(C(=O)C1=CNc1cc(ccc1C(=O)OC)C(=O)OC)c1ccc(cc1)F
CCCC1=NN(C(=O)C1=CNC2=C(C=CC(=C2)C(=O)OC)C(=O)OC)C3=CC=C(C=C3)F
dimethyl2(((Z)(1(4fluorophenyl)5oxo3propyl15dihydro4Hpyrazol4ylidene)methyl)amino)benzene14dicarboxylate
DIMETHYL2(((Z)(1(4FLUOROPHENYL)5OXO3PROPYLPYRAZOL4YLIDENE)METHYL)AMINO)BENZENE14DICARBOXYLATE
InChI=1SC23H22FN3O5c1451918(21(28)27(2619)169715(24)81016)1325201214(22(29)312)61117(20)23(30)323h61325H45H213H3b1813
MFCD03036204
ZINC000100110558
ZINC08659875
ZINC100110558
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