2-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-N-(3,4-dimethoxyphenyl)propanamide

Systemtic Name: 2-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-N-(3,4-dimethoxyphenyl)propanamide Openeye Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-N-(3,4-dimethoxyphenyl)propanamide CAS Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-N-(3,4-dimethoxyphenyl)propanamide IUPAC Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-N-(3,4-dimethoxyphenyl)propanamide Traditional Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-N-(3,4-dimethoxyphenyl)propionamide Formula: C19H20ClNO5S MolecularWeight: 409.8838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)OC)OC)SCC2=CC3=C(C(=C2)Cl)OCO3

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1)OC)OC)SCC2=CC3=C(C(=C2)Cl)OCO3

InChI

InChI=1S/C19H20ClNO5S/c1-11(19(22)21-13-4-5-15(23-2)16(8-13)24-3)27-9-12-6-14(20)18-17(7-12)25-10-26-18/h4-8,11H,9-10H2,1-3H3,(H,21,22)