ethyl 4-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-butanoate Openeye Name: ethyl 4-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-2-(4-methylthiazol-2-yl)-3-oxo-butanoate CAS Name: 4-[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]thio]-2-(4-methyl-2-thiazolyl)-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-2-(4-methyl-1,3-thiazol-2-yl)-3-oxobutanoate Traditional Name: 4-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]thio]-3-keto-2-(4-methylthiazol-2-yl)butyric acid ethyl ester Formula: C19H21N5O3S2 MolecularWeight: 431.53174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=NC(=CS1)C)C(=O)CSC2=NN=C(C=C2)N3C(=CC(=N3)C)C

Isomeric SMILES

CCOC(=O)C(C1=NC(=CS1)C)C(=O)CSC2=NN=C(C=C2)N3C(=CC(=N3)C)C

InChI

InChI=1S/C19H21N5O3S2/c1-5-27-19(26)17(18-20-12(3)9-29-18)14(25)10-28-16-7-6-15(21-22-16)24-13(4)8-11(2)23-24/h6-9,17H,5,10H2,1-4H3