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

Systemtic Name: 2-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-N-phenyl-propanamide Openeye Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-N-phenyl-propanamide CAS Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-N-phenylpropanamide IUPAC Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-N-phenylpropanamide Traditional Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-N-phenyl-propionamide Formula: C17H16ClNO3S MolecularWeight: 349.83184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClNO3S/c1-11(17(20)19-13-5-3-2-4-6-13)23-9-12-7-14(18)16-15(8-12)21-10-22-16/h2-8,11H,9-10H2,1H3,(H,19,20)