N-(1,3-benzodioxol-5-ylmethyl)-3-phenylsulfanyl-propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-phenylsulfanyl-propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-phenylsulfanyl-propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(phenylthio)propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-phenylsulfanylpropanamide Traditional Name: 3-(phenylthio)-N-piperonyl-propionamide Formula: C17H17NO3S MolecularWeight: 315.38678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCSC3=CC=CC=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCSC3=CC=CC=C3

InChI

InChI=1S/C17H17NO3S/c19-17(8-9-22-14-4-2-1-3-5-14)18-11-13-6-7-15-16(10-13)21-12-20-15/h1-7,10H,8-9,11-12H2,(H,18,19)