ethyl 2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-4-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanyl-butanoate

Systemtic Name: ethyl 2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-4-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanyl-butanoate Openeye Name: ethyl 4-[1-(2-isopropylphenyl)imidazol-2-yl]sulfanyl-2-(4-methylthiazol-2-yl)-3-oxo-butanoate CAS Name: 2-(4-methyl-2-thiazolyl)-3-oxo-4-[[1-(2-propan-2-ylphenyl)-2-imidazolyl]thio]butanoic acid ethyl ester IUPAC Name: ethyl 2-(4-methyl-1,3-thiazol-2-yl)-3-oxo-4-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylbutanoate Traditional Name: 3-keto-2-(4-methylthiazol-2-yl)-4-[(1-o-cumenylimidazol-2-yl)thio]butyric acid ethyl ester Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=NC(=CS1)C)C(=O)CSC2=NC=CN2C3=CC=CC=C3C(C)C

Isomeric SMILES

CCOC(=O)C(C1=NC(=CS1)C)C(=O)CSC2=NC=CN2C3=CC=CC=C3C(C)C

InChI

InChI=1S/C22H25N3O3S2/c1-5-28-21(27)19(20-24-15(4)12-29-20)18(26)13-30-22-23-10-11-25(22)17-9-7-6-8-16(17)14(2)3/h6-12,14,19H,5,13H2,1-4H3