[2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methyl 4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanoate

Systemtic Name: [2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methyl 4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanoate Openeye Name: [2-(4-isopropylphenyl)thiazol-4-yl]methyl 4-(5-methyl-2-thienyl)-4-oxo-butanoate CAS Name: 4-(5-methyl-2-thiophenyl)-4-oxobutanoic acid [2-(4-propan-2-ylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methyl 4-(5-methylthiophen-2-yl)-4-oxobutanoate Traditional Name: 4-keto-4-(5-methyl-2-thienyl)butyric acid (2-p-cumenylthiazol-4-yl)methyl ester Formula: C22H23NO3S2 MolecularWeight: 413.55292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCC(=O)OCC2=CSC(=N2)C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCC(=O)OCC2=CSC(=N2)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C22H23NO3S2/c1-14(2)16-5-7-17(8-6-16)22-23-18(13-27-22)12-26-21(25)11-9-19(24)20-10-4-15(3)28-20/h4-8,10,13-14H,9,11-12H2,1-3H3