N-(2-bromanyl-4-methyl-phenyl)-2-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]ethanamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]ethanamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]acetamide CAS Name: N-(2-bromo-4-methylphenyl)-2-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]acetamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]acetamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]acetamide Formula: C17H15BrClNO3S MolecularWeight: 428.7279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSCC2=CC3=C(C(=C2)Cl)OCO3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSCC2=CC3=C(C(=C2)Cl)OCO3)Br

InChI

InChI=1S/C17H15BrClNO3S/c1-10-2-3-14(12(18)4-10)20-16(21)8-24-7-11-5-13(19)17-15(6-11)22-9-23-17/h2-6H,7-9H2,1H3,(H,20,21)