N-(1,3-benzodioxol-5-ylmethyl)-2-(4-fluorophenyl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-fluorophenyl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-fluorophenyl)sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-fluorophenyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-fluorophenyl)sulfanylacetamide Traditional Name: 2-[(4-fluorophenyl)thio]-N-piperonyl-acetamide Formula: C16H14FNO3S MolecularWeight: 319.350663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=CC=C(C=C3)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=CC=C(C=C3)F

InChI

InChI=1S/C16H14FNO3S/c17-12-2-4-13(5-3-12)22-9-16(19)18-8-11-1-6-14-15(7-11)21-10-20-14/h1-7H,8-10H2,(H,18,19)