N-(1,3-benzodioxol-5-yl)-2-phenylsulfanyl-propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-phenylsulfanyl-propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-phenylsulfanyl-propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-(phenylthio)propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-phenylsulfanylpropanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-(phenylthio)propionamide Formula: C16H15NO3S MolecularWeight: 301.3602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCO2)SC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)OCO2)SC3=CC=CC=C3

InChI

InChI=1S/C16H15NO3S/c1-11(21-13-5-3-2-4-6-13)16(18)17-12-7-8-14-15(9-12)20-10-19-14/h2-9,11H,10H2,1H3,(H,17,18)