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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)CSCC(=O)NCC3=CC=CC=C3)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)CSCC(=O)NCC3=CC=CC=C3)Br

InChI

InChI=1S/C17H16BrNO3S/c18-14-7-16-15(21-11-22-16)6-13(14)9-23-10-17(20)19-8-12-4-2-1-3-5-12/h1-7H,8-11H2,(H,19,20)