N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[(2-fluorobenzyl)thio]ethyl]-piperonylamide Formula: C17H16FNO3S MolecularWeight: 333.377243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NCCSCC3=CC=CC=C3F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NCCSCC3=CC=CC=C3F

InChI

InChI=1S/C17H16FNO3S/c18-14-4-2-1-3-13(14)10-23-8-7-19-17(20)12-5-6-15-16(9-12)22-11-21-15/h1-6,9H,7-8,10-11H2,(H,19,20)