N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(3,4-dimethoxyphenyl)propanamide

Systemtic Name: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(3,4-dimethoxyphenyl)propanamide Openeye Name: N-[4-(4-bromophenyl)thiazol-2-yl]-3-(3,4-dimethoxyphenyl)propanamide CAS Name: N-[4-(4-bromophenyl)-2-thiazolyl]-3-(3,4-dimethoxyphenyl)propanamide IUPAC Name: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(3,4-dimethoxyphenyl)propanamide Traditional Name: N-[4-(4-bromophenyl)thiazol-2-yl]-3-(3,4-dimethoxyphenyl)propionamide Formula: C20H19BrN2O3S MolecularWeight: 447.34546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C20H19BrN2O3S/c1-25-17-9-3-13(11-18(17)26-2)4-10-19(24)23-20-22-16(12-27-20)14-5-7-15(21)8-6-14/h3,5-9,11-12H,4,10H2,1-2H3,(H,22,23,24)