N-[2-(4-bromophenyl)sulfanylethyl]-3-(3,5-dimethoxyphenyl)propanamide

Systemtic Name: N-[2-(4-bromophenyl)sulfanylethyl]-3-(3,5-dimethoxyphenyl)propanamide Openeye Name: N-[2-(4-bromophenyl)sulfanylethyl]-3-(3,5-dimethoxyphenyl)propanamide CAS Name: N-[2-[(4-bromophenyl)thio]ethyl]-3-(3,5-dimethoxyphenyl)propanamide IUPAC Name: N-[2-(4-bromophenyl)sulfanylethyl]-3-(3,5-dimethoxyphenyl)propanamide Traditional Name: N-[2-[(4-bromophenyl)thio]ethyl]-3-(3,5-dimethoxyphenyl)propionamide Formula: C19H22BrNO3S MolecularWeight: 424.35188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CCC(=O)NCCSC2=CC=C(C=C2)Br)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CCC(=O)NCCSC2=CC=C(C=C2)Br)OC

InChI

InChI=1S/C19H22BrNO3S/c1-23-16-11-14(12-17(13-16)24-2)3-8-19(22)21-9-10-25-18-6-4-15(20)5-7-18/h4-7,11-13H,3,8-10H2,1-2H3,(H,21,22)