2-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-N-(2-methoxy-5-methyl-phenyl)propanamide

Systemtic Name: 2-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-N-(2-methoxy-5-methyl-phenyl)propanamide Openeye Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-N-(2-methoxy-5-methyl-phenyl)propanamide CAS Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-N-(2-methoxy-5-methylphenyl)propanamide IUPAC Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-N-(2-methoxy-5-methylphenyl)propanamide Traditional Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-N-(2-methoxy-5-methyl-phenyl)propionamide Formula: C19H20ClNO4S MolecularWeight: 393.8844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(C)SCC2=CC3=C(C(=C2)Cl)OCO3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)C(C)SCC2=CC3=C(C(=C2)Cl)OCO3

InChI

InChI=1S/C19H20ClNO4S/c1-11-4-5-16(23-3)15(6-11)21-19(22)12(2)26-9-13-7-14(20)18-17(8-13)24-10-25-18/h4-8,12H,9-10H2,1-3H3,(H,21,22)