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

Systemtic Name: 2-[2-(naphthalen-1-ylamino)-4-(4-phenoxyphenyl)-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[2-(1-naphthylamino)-4-(4-phenoxyphenyl)thiazol-5-yl]acetic acid CAS Name: 2-[2-(1-naphthalenylamino)-4-(4-phenoxyphenyl)-5-thiazolyl]acetic acid IUPAC Name: 2-[2-(naphthalen-1-ylamino)-4-(4-phenoxyphenyl)-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[2-(1-naphthylamino)-4-(4-phenoxyphenyl)thiazol-5-yl]acetic acid Formula: C27H20N2O3S MolecularWeight: 452.5243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=C(SC(=N3)NC4=CC=CC5=CC=CC=C54)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=C(SC(=N3)NC4=CC=CC5=CC=CC=C54)CC(=O)O

InChI

InChI=1S/C27H20N2O3S/c30-25(31)17-24-26(19-13-15-21(16-14-19)32-20-9-2-1-3-10-20)29-27(33-24)28-23-12-6-8-18-7-4-5-11-22(18)23/h1-16H,17H2,(H,28,29)(H,30,31)