Vitas-M small molecule compound
ethyl 5'-({(E)-[3-methyl-1-(4-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-2,3'-bithiophene-4'-carboxylate
Catalog ID
STK537402
SMILES CCOC(=O)c1c(N/C=C/2\C(=NN(C2=O)c2ccc(cc2)C)C)scc1c1cccs1
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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 C23H21N3O3S2 MW 451.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O3S2/c1-4-29-23(28)20-18(19-6-5-11-30-19)13-31-21(20)24-12-17-15(3)25-26(22(17)27)16-9-7-14(2)8-10-16/h5-13,24H,4H2,1-3H3/b17-12+InChIKey
RHXHYKYYMFFEBG-SFQUDFHCSA-NSynonyms
(E)ethyl5(((3methyl5oxo1(ptolyl)1Hpyrazol4(5H)ylidene)methyl)amino)(23bithiophene)4carboxylate
CCOC(=O)C1=C(SC=C1C2=CC=CS2)NC=C3C(=NN(C3=O)C4=CC=C(C=C4)C)C
CCOC(=O)c1c(NC=C2C(=NN(C2=O)c2ccc(cc2)C)C)scc1c1cccs1
ETHYL2(((E)(3METHYL1(4METHYLPHENYL)5OXOPYRAZOL4YLIDENE)METHYL)AMINO)4THIOPHEN2YLTHIOPHENE3CARBOXYLATE
ethyl5(((E)(3methyl1(4methylphenyl)5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)23bithiophene4carboxylate
InChI=1SC23H21N3O3S2c142923(28)2018(1965113019)133121(20)24121715(3)2526(22(17)27)169714(2)81016h51324H4H213H3b1712+
MFCD01951592
ZINC000100209372
ZINC01302558
ZINC100209372
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