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

Systemtic Name: 3-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-N-(5-chloranyl-2-methoxy-phenyl)propanamide Openeye Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-N-(5-chloro-2-methoxy-phenyl)propanamide CAS Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-N-(5-chloro-2-methoxyphenyl)propanamide IUPAC Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-N-(5-chloro-2-methoxyphenyl)propanamide Traditional Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-N-(5-chloro-2-methoxy-phenyl)propionamide Formula: C18H17Cl2NO4S MolecularWeight: 414.30288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CCSCC2=CC3=C(C(=C2)Cl)OCO3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CCSCC2=CC3=C(C(=C2)Cl)OCO3

InChI

InChI=1S/C18H17Cl2NO4S/c1-23-15-3-2-12(19)8-14(15)21-17(22)4-5-26-9-11-6-13(20)18-16(7-11)24-10-25-18/h2-3,6-8H,4-5,9-10H2,1H3,(H,21,22)