1-(5-thiophen-3-ylpyridin-3-yl)-1,4-diazepane

Systemtic Name: 1-(5-thiophen-3-ylpyridin-3-yl)-1,4-diazepane Openeye Name: 1-[5-(3-thienyl)-3-pyridyl]-1,4-diazepane CAS Name: 1-[5-(3-thiophenyl)-3-pyridinyl]-1,4-diazepane IUPAC Name: 1-(5-thiophen-3-ylpyridin-3-yl)-1,4-diazepane Traditional Name: 1-[5-(3-thienyl)-3-pyridyl]-1,4-diazepane Formula: C14H17N3S MolecularWeight: 259.36988

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=CN=CC(=C2)C3=CSC=C3

Isomeric SMILES

C1CNCCN(C1)C2=CN=CC(=C2)C3=CSC=C3

InChI

InChI=1S/C14H17N3S/c1-3-15-4-6-17(5-1)14-8-13(9-16-10-14)12-2-7-18-11-12/h2,7-11,15H,1,3-6H2