4-[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanyl-1-ethoxy-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-but-1-en-1-olate

Systemtic Name: 4-[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanyl-1-ethoxy-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-but-1-en-1-olate Openeye Name: 4-[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanyl-1-ethoxy-2-(4-methylthiazol-2-yl)-3-oxo-but-1-en-1-olate CAS Name: 4-[[1-(2,5-dimethylphenyl)-2-imidazolyl]thio]-1-ethoxy-2-(4-methyl-2-thiazolyl)-3-oxo-1-buten-1-olate IUPAC Name: 4-[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanyl-1-ethoxy-2-(4-methyl-1,3-thiazol-2-yl)-3-oxobut-1-en-1-olate Traditional Name: 4-[[1-(2,5-dimethylphenyl)imidazol-2-yl]thio]-1-ethoxy-3-keto-2-(4-methylthiazol-2-yl)but-1-en-1-olate Formula: C21H22N3O3S2- MolecularWeight: 428.54768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C1=NC(=CS1)C)C(=O)CSC2=NC=CN2C3=C(C=CC(=C3)C)C)[O-]

Isomeric SMILES

CCOC(=C(C1=NC(=CS1)C)C(=O)CSC2=NC=CN2C3=C(C=CC(=C3)C)C)[O-]

InChI

InChI=1S/C21H23N3O3S2/c1-5-27-20(26)18(19-23-15(4)11-28-19)17(25)12-29-21-22-8-9-24(21)16-10-13(2)6-7-14(16)3/h6-11,26H,5,12H2,1-4H3/p-1