Vitas-M small molecule compound
diethyl 5-({(E)-[1-(3,4-dimethylphenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-3-methylthiophene-2,4-dicarboxylate
Catalog ID
STL295648
SMILES CCOC(=O)c1c(N/C=C/2\C(=NN(C2=O)c2ccc(c(c2)C)C)C)sc(c1C)C(=O)OCC
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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 C24H27N3O5S MW 469.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N3O5S/c1-7-31-23(29)19-15(5)20(24(30)32-8-2)33-21(19)25-12-18-16(6)26-27(22(18)28)17-10-9-13(3)14(4)11-17/h9-12,25H,7-8H2,1-6H3/b18-12+InChIKey
ZDZMNQSDVMNLLC-LDADJPATSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC=C2C(=NN(C2=O)C3=CC(=C(C=C3)C)C)C
CCOC(=O)c1c(NC=C2C(=NN(C2=O)c2ccc(c(c2)C)C)C)sc(c1C)C(=O)OCC
diethyl5(((E)(1(34dimethylphenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)3methylthiophene24dicarboxylate
diethyl5(((E)(1(34dimethylphenyl)3methyl5oxopyrazol4ylidene)methyl)amino)3methylthiophene24dicarboxylate
InChI=1SC24H27N3O5Sc173123(29)1915(5)20(24(30)3282)3321(19)25121816(6)2627(22(18)28)1710913(3)14(4)1117h91225H78H216H3b1812+
MFCD28033065
ZINC000101112493
ZINC101112493
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