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

Systemtic Name: 3-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-N-[(2-chlorophenyl)methyl]propanamide Openeye Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-N-[(2-chlorophenyl)methyl]propanamide CAS Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-N-[(2-chlorophenyl)methyl]propanamide IUPAC Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-N-[(2-chlorophenyl)methyl]propanamide Traditional Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-N-(2-chlorobenzyl)propionamide Formula: C18H17Cl2NO3S MolecularWeight: 398.30348

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)CSCCC(=O)NCC3=CC=CC=C3Cl)Cl

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)CSCCC(=O)NCC3=CC=CC=C3Cl)Cl

InChI

InChI=1S/C18H17Cl2NO3S/c19-14-4-2-1-3-13(14)9-21-17(22)5-6-25-10-12-7-15(20)18-16(8-12)23-11-24-18/h1-4,7-8H,5-6,9-11H2,(H,21,22)