[2-(5-methylthiophen-2-yl)-2-oxidanylidene-ethyl] 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propanoate

Systemtic Name: [2-(5-methylthiophen-2-yl)-2-oxidanylidene-ethyl] 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propanoate Openeye Name: [2-(5-methyl-2-thienyl)-2-oxo-ethyl] 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propanoate CAS Name: 3-[1-(3-methoxyphenyl)-3,5-dimethyl-4-pyrazolyl]propanoic acid [2-(5-methyl-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-methylthiophen-2-yl)-2-oxoethyl] 3-[1-(3-methoxyphenyl)-3,5-dimethylpyrazol-4-yl]propanoate Traditional Name: 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propionic acid [2-keto-2-(5-methyl-2-thienyl)ethyl] ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)COC(=O)CCC2=C(N(N=C2C)C3=CC(=CC=C3)OC)C

Isomeric SMILES

CC1=CC=C(S1)C(=O)COC(=O)CCC2=C(N(N=C2C)C3=CC(=CC=C3)OC)C

InChI

InChI=1S/C22H24N2O4S/c1-14-8-10-21(29-14)20(25)13-28-22(26)11-9-19-15(2)23-24(16(19)3)17-6-5-7-18(12-17)27-4/h5-8,10,12H,9,11,13H2,1-4H3