1-(2-pyridin-2-yl-1-thiophen-2-yl-ethyl)-1,4-diazepane

Systemtic Name: 1-(2-pyridin-2-yl-1-thiophen-2-yl-ethyl)-1,4-diazepane Openeye Name: 1-[2-(2-pyridyl)-1-(2-thienyl)ethyl]-1,4-diazepane CAS Name: 1-[2-(2-pyridinyl)-1-thiophen-2-ylethyl]-1,4-diazepane IUPAC Name: 1-(2-pyridin-2-yl-1-thiophen-2-ylethyl)-1,4-diazepane Traditional Name: 1-[2-(2-pyridyl)-1-(2-thienyl)ethyl]-1,4-diazepane Formula: C16H21N3S MolecularWeight: 287.42304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(CC2=CC=CC=N2)C3=CC=CS3

Isomeric SMILES

C1CNCCN(C1)C(CC2=CC=CC=N2)C3=CC=CS3

InChI

InChI=1S/C16H21N3S/c1-2-8-18-14(5-1)13-15(16-6-3-12-20-16)19-10-4-7-17-9-11-19/h1-3,5-6,8,12,15,17H,4,7,9-11,13H2