2-[2-(4-dimethylaminophenyl)-4-(2,4-dimethylphenyl)-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[2-(4-dimethylaminophenyl)-4-(2,4-dimethylphenyl)-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[2-(4-dimethylaminophenyl)-4-(2,4-dimethylphenyl)thiazol-5-yl]acetic acid CAS Name: 2-[2-(4-dimethylaminophenyl)-4-(2,4-dimethylphenyl)-5-thiazolyl]acetic acid IUPAC Name: 2-[2-(4-dimethylaminophenyl)-4-(2,4-dimethylphenyl)-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[2-(4-dimethylaminophenyl)-4-(2,4-dimethylphenyl)thiazol-5-yl]acetic acid Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C(SC(=N2)C3=CC=C(C=C3)N(C)C)CC(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C(SC(=N2)C3=CC=C(C=C3)N(C)C)CC(=O)O)C

InChI

InChI=1S/C21H22N2O2S/c1-13-5-10-17(14(2)11-13)20-18(12-19(24)25)26-21(22-20)15-6-8-16(9-7-15)23(3)4/h5-11H,12H2,1-4H3,(H,24,25)