2-[2-(3-butoxyphenyl)-4-(4-methylphenyl)-1,3-thiazol-5-yl]ethanoate

Systemtic Name: 2-[2-(3-butoxyphenyl)-4-(4-methylphenyl)-1,3-thiazol-5-yl]ethanoate Openeye Name: 2-[2-(3-butoxyphenyl)-4-(p-tolyl)thiazol-5-yl]acetate CAS Name: 2-[2-(3-butoxyphenyl)-4-(4-methylphenyl)-5-thiazolyl]acetate IUPAC Name: 2-[2-(3-butoxyphenyl)-4-(4-methylphenyl)-1,3-thiazol-5-yl]acetate Traditional Name: 2-[2-(3-butoxyphenyl)-4-(p-tolyl)thiazol-5-yl]acetate Formula: C22H22NO3S- MolecularWeight: 380.47998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2=NC(=C(S2)CC(=O)[O-])C3=CC=C(C=C3)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C2=NC(=C(S2)CC(=O)[O-])C3=CC=C(C=C3)C

InChI

InChI=1S/C22H23NO3S/c1-3-4-12-26-18-7-5-6-17(13-18)22-23-21(19(27-22)14-20(24)25)16-10-8-15(2)9-11-16/h5-11,13H,3-4,12,14H2,1-2H3,(H,24,25)/p-1