4-pyridin-2-yl-1-(thiophen-2-ylmethyl)azepane

Systemtic Name: 4-pyridin-2-yl-1-(thiophen-2-ylmethyl)azepane Openeye Name: 4-(2-pyridyl)-1-(2-thienylmethyl)azepane CAS Name: 4-(2-pyridinyl)-1-(thiophen-2-ylmethyl)azepane IUPAC Name: 4-pyridin-2-yl-1-(thiophen-2-ylmethyl)azepane Traditional Name: 4-(2-pyridyl)-1-(2-thenyl)azepane Formula: C16H20N2S MolecularWeight: 272.4084

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCN(C1)CC2=CC=CS2)C3=CC=CC=N3

Isomeric SMILES

C1CC(CCN(C1)CC2=CC=CS2)C3=CC=CC=N3

InChI

InChI=1S/C16H20N2S/c1-2-9-17-16(7-1)14-5-3-10-18(11-8-14)13-15-6-4-12-19-15/h1-2,4,6-7,9,12,14H,3,5,8,10-11,13H2