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

Systemtic Name: [2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methyl 4-oxidanylidene-4-thiophen-2-yl-butanoate Openeye Name: [2-(4-isopropylphenyl)thiazol-4-yl]methyl 4-oxo-4-(2-thienyl)butanoate CAS Name: 4-oxo-4-thiophen-2-ylbutanoic acid [2-(4-propan-2-ylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methyl 4-oxo-4-thiophen-2-ylbutanoate Traditional Name: 4-keto-4-(2-thienyl)butyric acid (2-p-cumenylthiazol-4-yl)methyl ester Formula: C21H21NO3S2 MolecularWeight: 399.52634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC(=CS2)COC(=O)CCC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC(=CS2)COC(=O)CCC(=O)C3=CC=CS3

InChI

InChI=1S/C21H21NO3S2/c1-14(2)15-5-7-16(8-6-15)21-22-17(13-27-21)12-25-20(24)10-9-18(23)19-4-3-11-26-19/h3-8,11,13-14H,9-10,12H2,1-2H3