Vitas-M small molecule compound
dimethyl 3-methyl-5-{[(Z)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}thiophene-2,4-dicarboxylate
Catalog ID
STK898028
SMILES COC(=O)c1c(N/C=C\2/C(=NN(C2=O)c2ccccc2)C)sc(c1C)C(=O)OC
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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 C20H19N3O5S MW 413.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O5S/c1-11-15(19(25)27-3)17(29-16(11)20(26)28-4)21-10-14-12(2)22-23(18(14)24)13-8-6-5-7-9-13/h5-10,21H,1-4H3/b14-10-InChIKey
IOSRIICGGZIKLL-UVTDQMKNSA-NSynonyms
CC1=C(SC(=C1C(=O)OC)NC=C2C(=NN(C2=O)C3=CC=CC=C3)C)C(=O)OC
COC(=O)c1c(NC=C2C(=NN(C2=O)c2ccccc2)C)sc(c1C)C(=O)OC
dimethyl3methyl5(((Z)(3methyl5oxo1phenyl15dihydro4Hpyrazol4ylidene)methyl)amino)thiophene24dicarboxylate
dimethyl3methyl5(((Z)(3methyl5oxo1phenylpyrazol4ylidene)methyl)amino)thiophene24dicarboxylate
InChI=1SC20H19N3O5Sc11115(19(25)273)17(2916(11)20(26)284)21101412(2)2223(18(14)24)138657913h51021H14H3b1410
MFCD18172788
ZINC000044827034
ZINC44827034
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