N-[(3,4-dimethoxyphenyl)methyl]-2-phenylsulfanyl-propanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-phenylsulfanyl-propanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-phenylsulfanyl-propanamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(phenylthio)propanamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-phenylsulfanylpropanamide Traditional Name: 2-(phenylthio)-N-veratryl-propionamide Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC(=C(C=C1)OC)OC)SC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NCC1=CC(=C(C=C1)OC)OC)SC2=CC=CC=C2

InChI

InChI=1S/C18H21NO3S/c1-13(23-15-7-5-4-6-8-15)18(20)19-12-14-9-10-16(21-2)17(11-14)22-3/h4-11,13H,12H2,1-3H3,(H,19,20)