3-(3,4-dimethoxyphenyl)-N-(3-phenylsulfanylpropyl)propanamide

Systemtic Name: 3-(3,4-dimethoxyphenyl)-N-(3-phenylsulfanylpropyl)propanamide Openeye Name: 3-(3,4-dimethoxyphenyl)-N-(3-phenylsulfanylpropyl)propanamide CAS Name: 3-(3,4-dimethoxyphenyl)-N-[3-(phenylthio)propyl]propanamide IUPAC Name: 3-(3,4-dimethoxyphenyl)-N-(3-phenylsulfanylpropyl)propanamide Traditional Name: 3-(3,4-dimethoxyphenyl)-N-[3-(phenylthio)propyl]propionamide Formula: C20H25NO3S MolecularWeight: 359.4824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)NCCCSC2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)NCCCSC2=CC=CC=C2)OC

InChI

InChI=1S/C20H25NO3S/c1-23-18-11-9-16(15-19(18)24-2)10-12-20(22)21-13-6-14-25-17-7-4-3-5-8-17/h3-5,7-9,11,15H,6,10,12-14H2,1-2H3,(H,21,22)