N-[(3,4-dimethoxyphenyl)methyl]-3-(4-fluorophenyl)sulfanyl-propanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(4-fluorophenyl)sulfanyl-propanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(4-fluorophenyl)sulfanyl-propanamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-3-[(4-fluorophenyl)thio]propanamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(4-fluorophenyl)sulfanylpropanamide Traditional Name: 3-[(4-fluorophenyl)thio]-N-veratryl-propionamide Formula: C18H20FNO3S MolecularWeight: 349.419703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CCSC2=CC=C(C=C2)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CCSC2=CC=C(C=C2)F)OC

InChI

InChI=1S/C18H20FNO3S/c1-22-16-8-3-13(11-17(16)23-2)12-20-18(21)9-10-24-15-6-4-14(19)5-7-15/h3-8,11H,9-10,12H2,1-2H3,(H,20,21)