N-[2-(1,3-benzodioxol-5-ylmethylsulfanyl)phenyl]-3-chloranyl-2,2-dimethyl-propanamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylmethylsulfanyl)phenyl]-3-chloranyl-2,2-dimethyl-propanamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylmethylsulfanyl)phenyl]-3-chloro-2,2-dimethyl-propanamide CAS Name: N-[2-(1,3-benzodioxol-5-ylmethylthio)phenyl]-3-chloro-2,2-dimethylpropanamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylmethylsulfanyl)phenyl]-3-chloro-2,2-dimethylpropanamide Traditional Name: 3-chloro-2,2-dimethyl-N-[2-(piperonylthio)phenyl]propionamide Formula: C19H20ClNO3S MolecularWeight: 377.885

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCl)C(=O)NC1=CC=CC=C1SCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(CCl)C(=O)NC1=CC=CC=C1SCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H20ClNO3S/c1-19(2,11-20)18(22)21-14-5-3-4-6-17(14)25-10-13-7-8-15-16(9-13)24-12-23-15/h3-9H,10-12H2,1-2H3,(H,21,22)