2-[4-[2-[methyl(thiophen-3-ylmethyl)amino]ethoxy]phenyl]ethanenitrile

Systemtic Name: 2-[4-[2-[methyl(thiophen-3-ylmethyl)amino]ethoxy]phenyl]ethanenitrile Openeye Name: 2-[4-[2-[methyl(3-thienylmethyl)amino]ethoxy]phenyl]acetonitrile CAS Name: 2-[4-[2-[methyl(3-thiophenylmethyl)amino]ethoxy]phenyl]acetonitrile IUPAC Name: 2-[4-[2-[methyl(thiophen-3-ylmethyl)amino]ethoxy]phenyl]acetonitrile Traditional Name: 2-[4-[2-[methyl(3-thenyl)amino]ethoxy]phenyl]acetonitrile Formula: C16H18N2OS MolecularWeight: 286.39192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=C(C=C1)CC#N)CC2=CSC=C2

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)CC#N)CC2=CSC=C2

InChI

InChI=1S/C16H18N2OS/c1-18(12-15-7-11-20-13-15)9-10-19-16-4-2-14(3-5-16)6-8-17/h2-5,7,11,13H,6,9-10,12H2,1H3