2-[2-[(4-bromophenyl)amino]-4-(3,4-dimethylphenyl)-1,3-thiazol-5-yl]ethanoate

Systemtic Name: 2-[2-[(4-bromophenyl)amino]-4-(3,4-dimethylphenyl)-1,3-thiazol-5-yl]ethanoate Openeye Name: 2-[2-(4-bromoanilino)-4-(3,4-dimethylphenyl)thiazol-5-yl]acetate CAS Name: 2-[2-(4-bromoanilino)-4-(3,4-dimethylphenyl)-5-thiazolyl]acetate IUPAC Name: 2-[2-(4-bromoanilino)-4-(3,4-dimethylphenyl)-1,3-thiazol-5-yl]acetate Traditional Name: 2-[2-(4-bromoanilino)-4-(3,4-dimethylphenyl)thiazol-5-yl]acetate Formula: C19H16BrN2O2S- MolecularWeight: 416.31154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(SC(=N2)NC3=CC=C(C=C3)Br)CC(=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(SC(=N2)NC3=CC=C(C=C3)Br)CC(=O)[O-])C

InChI

InChI=1S/C19H17BrN2O2S/c1-11-3-4-13(9-12(11)2)18-16(10-17(23)24)25-19(22-18)21-15-7-5-14(20)6-8-15/h3-9H,10H2,1-2H3,(H,21,22)(H,23,24)/p-1