2-[4-(4-methylphenyl)-2-(3-propoxyphenyl)-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[4-(4-methylphenyl)-2-(3-propoxyphenyl)-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[2-(3-propoxyphenyl)-4-(p-tolyl)thiazol-5-yl]acetic acid CAS Name: 2-[4-(4-methylphenyl)-2-(3-propoxyphenyl)-5-thiazolyl]acetic acid IUPAC Name: 2-[4-(4-methylphenyl)-2-(3-propoxyphenyl)-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[2-(3-propoxyphenyl)-4-(p-tolyl)thiazol-5-yl]acetic acid Formula: C21H21NO3S MolecularWeight: 367.46134

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C2=NC(=C(S2)CC(=O)O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCOC1=CC=CC(=C1)C2=NC(=C(S2)CC(=O)O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H21NO3S/c1-3-11-25-17-6-4-5-16(12-17)21-22-20(18(26-21)13-19(23)24)15-9-7-14(2)8-10-15/h4-10,12H,3,11,13H2,1-2H3,(H,23,24)