2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-N-(2-methylphenyl)ethanamide

Systemtic Name: 2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-N-(2-methylphenyl)ethanamide Openeye Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-N-(o-tolyl)acetamide CAS Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-N-(2-methylphenyl)acetamide IUPAC Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-N-(2-methylphenyl)acetamide Traditional Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-N-(o-tolyl)acetamide Formula: C17H16BrNO3S MolecularWeight: 394.28284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CSCC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CSCC2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C17H16BrNO3S/c1-11-4-2-3-5-14(11)19-17(20)9-23-8-12-6-15-16(7-13(12)18)22-10-21-15/h2-7H,8-10H2,1H3,(H,19,20)