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

Systemtic Name: 2-[4-(2,4-dimethylphenyl)-2-(naphthalen-1-ylamino)-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[4-(2,4-dimethylphenyl)-2-(1-naphthylamino)thiazol-5-yl]acetic acid CAS Name: 2-[4-(2,4-dimethylphenyl)-2-(1-naphthalenylamino)-5-thiazolyl]acetic acid IUPAC Name: 2-[4-(2,4-dimethylphenyl)-2-(naphthalen-1-ylamino)-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[4-(2,4-dimethylphenyl)-2-(1-naphthylamino)thiazol-5-yl]acetic acid Formula: C23H20N2O2S MolecularWeight: 388.4821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C(SC(=N2)NC3=CC=CC4=CC=CC=C43)CC(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C(SC(=N2)NC3=CC=CC4=CC=CC=C43)CC(=O)O)C

InChI

InChI=1S/C23H20N2O2S/c1-14-10-11-17(15(2)12-14)22-20(13-21(26)27)28-23(25-22)24-19-9-5-7-16-6-3-4-8-18(16)19/h3-12H,13H2,1-2H3,(H,24,25)(H,26,27)