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

Systemtic Name: 2-[4-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[4-(3,4-dimethoxyphenyl)-2-(1-naphthylamino)thiazol-5-yl]acetic acid CAS Name: 2-[4-(3,4-dimethoxyphenyl)-2-(1-naphthalenylamino)-5-thiazolyl]acetic acid IUPAC Name: 2-[4-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[4-(3,4-dimethoxyphenyl)-2-(1-naphthylamino)thiazol-5-yl]acetic acid Formula: C23H20N2O4S MolecularWeight: 420.4809

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(SC(=N2)NC3=CC=CC4=CC=CC=C43)CC(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(SC(=N2)NC3=CC=CC4=CC=CC=C43)CC(=O)O)OC

InChI

InChI=1S/C23H20N2O4S/c1-28-18-11-10-15(12-19(18)29-2)22-20(13-21(26)27)30-23(25-22)24-17-9-5-7-14-6-3-4-8-16(14)17/h3-12H,13H2,1-2H3,(H,24,25)(H,26,27)