3,4-dimethoxy-N-[2-(phenylmethylsulfanyl)ethyl]-5-[(E)-prop-1-enyl]benzamide

Systemtic Name: 3,4-dimethoxy-N-[2-(phenylmethylsulfanyl)ethyl]-5-[(E)-prop-1-enyl]benzamide Openeye Name: N-(2-benzylsulfanylethyl)-3,4-dimethoxy-5-[(E)-prop-1-enyl]benzamide CAS Name: 3,4-dimethoxy-N-[2-(phenylmethylthio)ethyl]-5-[(E)-prop-1-enyl]benzamide IUPAC Name: N-(2-benzylsulfanylethyl)-3,4-dimethoxy-5-[(E)-prop-1-enyl]benzamide Traditional Name: N-[2-(benzylthio)ethyl]-3,4-dimethoxy-5-[(E)-prop-1-enyl]benzamide Formula: C21H25NO3S MolecularWeight: 371.4931

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=C(C(=CC(=C1)C(=O)NCCSCC2=CC=CC=C2)OC)OC

Isomeric SMILES

C/C=C/C1=C(C(=CC(=C1)C(=O)NCCSCC2=CC=CC=C2)OC)OC

InChI

InChI=1S/C21H25NO3S/c1-4-8-17-13-18(14-19(24-2)20(17)25-3)21(23)22-11-12-26-15-16-9-6-5-7-10-16/h4-10,13-14H,11-12,15H2,1-3H3,(H,22,23)/b8-4+