N-[4-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]phenyl]ethanamide

Systemtic Name: N-[4-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]phenyl]ethanamide Openeye Name: N-[4-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]phenyl]acetamide CAS Name: N-[4-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]phenyl]acetamide IUPAC Name: N-[4-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]phenyl]acetamide Traditional Name: N-[4-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]phenyl]acetamide Formula: C16H14BrNO3S MolecularWeight: 380.25626

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCC2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C16H14BrNO3S/c1-10(19)18-12-2-4-13(5-3-12)22-8-11-6-15-16(7-14(11)17)21-9-20-15/h2-7H,8-9H2,1H3,(H,18,19)