N-(6-chloranyl-1,3-benzodioxol-5-yl)-2-methylsulfanyl-propanamide

Systemtic Name: N-(6-chloranyl-1,3-benzodioxol-5-yl)-2-methylsulfanyl-propanamide Openeye Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-methylsulfanyl-propanamide CAS Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-(methylthio)propanamide IUPAC Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-methylsulfanylpropanamide Traditional Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-(methylthio)propionamide Formula: C11H12ClNO3S MolecularWeight: 273.73588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1Cl)OCO2)SC

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1Cl)OCO2)SC

InChI

InChI=1S/C11H12ClNO3S/c1-6(17-2)11(14)13-8-4-10-9(3-7(8)12)15-5-16-10/h3-4,6H,5H2,1-2H3,(H,13,14)