N-[2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]phenyl]-2-methyl-propanamide

Systemtic Name: N-[2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]phenyl]-2-methyl-propanamide Openeye Name: N-[2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]phenyl]-2-methyl-propanamide CAS Name: N-[2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]phenyl]-2-methylpropanamide IUPAC Name: N-[2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]phenyl]-2-methylpropanamide Traditional Name: N-[2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]phenyl]-2-methyl-propionamide Formula: C19H20ClNO3S MolecularWeight: 377.885

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC=C1SCC2=C3C(=CC(=C2)Cl)COCO3

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC=C1SCC2=C3C(=CC(=C2)Cl)COCO3

InChI

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