1-[5-(1-pyridin-2-yl-1,4-diazepan-5-yl)thiophen-2-yl]ethanone

Systemtic Name: 1-[5-(1-pyridin-2-yl-1,4-diazepan-5-yl)thiophen-2-yl]ethanone Openeye Name: 1-[5-[1-(2-pyridyl)-1,4-diazepan-5-yl]-2-thienyl]ethanone CAS Name: 1-[5-[1-(2-pyridinyl)-1,4-diazepan-5-yl]-2-thiophenyl]ethanone IUPAC Name: 1-[5-(1-pyridin-2-yl-1,4-diazepan-5-yl)thiophen-2-yl]ethanone Traditional Name: 1-[5-[1-(2-pyridyl)-1,4-diazepan-5-yl]-2-thienyl]ethanone Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)C2CCN(CCN2)C3=CC=CC=N3

Isomeric SMILES

CC(=O)C1=CC=C(S1)C2CCN(CCN2)C3=CC=CC=N3

InChI

InChI=1S/C16H19N3OS/c1-12(20)14-5-6-15(21-14)13-7-10-19(11-9-17-13)16-4-2-3-8-18-16/h2-6,8,13,17H,7,9-11H2,1H3