1-(2-thiophen-2-ylpyridin-3-yl)-1,4-diazepane

Systemtic Name: 1-(2-thiophen-2-ylpyridin-3-yl)-1,4-diazepane Openeye Name: 1-[2-(2-thienyl)-3-pyridyl]-1,4-diazepane CAS Name: 1-(2-thiophen-2-yl-3-pyridinyl)-1,4-diazepane IUPAC Name: 1-(2-thiophen-2-ylpyridin-3-yl)-1,4-diazepane Traditional Name: 1-[2-(2-thienyl)-3-pyridyl]-1,4-diazepane Formula: C14H17N3S MolecularWeight: 259.36988

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=C(N=CC=C2)C3=CC=CS3

Isomeric SMILES

C1CNCCN(C1)C2=C(N=CC=C2)C3=CC=CS3

InChI

InChI=1S/C14H17N3S/c1-4-12(17-9-3-6-15-8-10-17)14(16-7-1)13-5-2-11-18-13/h1-2,4-5,7,11,15H,3,6,8-10H2