N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-4-(4-chloranyl-3,5-dimethyl-phenoxy)butanamide

Systemtic Name: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-4-(4-chloranyl-3,5-dimethyl-phenoxy)butanamide Openeye Name: N-[4-(4-bromophenyl)thiazol-2-yl]-4-(4-chloro-3,5-dimethyl-phenoxy)butanamide CAS Name: N-[4-(4-bromophenyl)-2-thiazolyl]-4-(4-chloro-3,5-dimethylphenoxy)butanamide IUPAC Name: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-4-(4-chloro-3,5-dimethylphenoxy)butanamide Traditional Name: N-[4-(4-bromophenyl)thiazol-2-yl]-4-(4-chloro-3,5-dimethyl-phenoxy)butyramide Formula: C21H20BrClN2O2S MolecularWeight: 479.8177

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCCCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCCCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H20BrClN2O2S/c1-13-10-17(11-14(2)20(13)23)27-9-3-4-19(26)25-21-24-18(12-28-21)15-5-7-16(22)8-6-15/h5-8,10-12H,3-4,9H2,1-2H3,(H,24,25,26)