2-[4-[(5-bromanylthiophen-2-yl)methylamino]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(5-bromanylthiophen-2-yl)methylamino]phenoxy]ethanenitrile Openeye Name: 2-[4-[(5-bromo-2-thienyl)methylamino]phenoxy]acetonitrile CAS Name: 2-[4-[(5-bromo-2-thiophenyl)methylamino]phenoxy]acetonitrile IUPAC Name: 2-[4-[(5-bromothiophen-2-yl)methylamino]phenoxy]acetonitrile Traditional Name: 2-[4-[(5-bromo-2-thienyl)methylamino]phenoxy]acetonitrile Formula: C13H11BrN2OS MolecularWeight: 323.20824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCC2=CC=C(S2)Br)OCC#N

Isomeric SMILES

C1=CC(=CC=C1NCC2=CC=C(S2)Br)OCC#N

InChI

InChI=1S/C13H11BrN2OS/c14-13-6-5-12(18-13)9-16-10-1-3-11(4-2-10)17-8-7-15/h1-6,16H,8-9H2