2-(2-chloranyl-4-propan-2-yl-phenoxy)-2-methyl-4-oxidanylidene-3-phenyl-3-(1,3-thiazol-5-yl)hexanoic acid

Systemtic Name: 2-(2-chloranyl-4-propan-2-yl-phenoxy)-2-methyl-4-oxidanylidene-3-phenyl-3-(1,3-thiazol-5-yl)hexanoic acid Openeye Name: 2-(2-chloro-4-isopropyl-phenoxy)-2-methyl-4-oxo-3-phenyl-3-thiazol-5-yl-hexanoic acid CAS Name: 2-(2-chloro-4-propan-2-ylphenoxy)-2-methyl-4-oxo-3-phenyl-3-(5-thiazolyl)hexanoic acid IUPAC Name: 2-(2-chloro-4-propan-2-ylphenoxy)-2-methyl-4-oxo-3-phenyl-3-(1,3-thiazol-5-yl)hexanoic acid Traditional Name: 2-(2-chloro-4-isopropyl-phenoxy)-4-keto-2-methyl-3-phenyl-3-thiazol-5-yl-hexanoic acid Formula: C25H26ClNO4S MolecularWeight: 471.99624

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C1=CC=CC=C1)(C2=CN=CS2)C(C)(C(=O)O)OC3=C(C=C(C=C3)C(C)C)Cl

Isomeric SMILES

CCC(=O)C(C1=CC=CC=C1)(C2=CN=CS2)C(C)(C(=O)O)OC3=C(C=C(C=C3)C(C)C)Cl

InChI

InChI=1S/C25H26ClNO4S/c1-5-21(28)25(22-14-27-15-32-22,18-9-7-6-8-10-18)24(4,23(29)30)31-20-12-11-17(16(2)3)13-19(20)26/h6-16H,5H2,1-4H3,(H,29,30)