1-[1-(5-ethylthiophen-2-yl)-2-pyridin-2-yl-ethyl]-1,4-diazepane

Systemtic Name: 1-[1-(5-ethylthiophen-2-yl)-2-pyridin-2-yl-ethyl]-1,4-diazepane Openeye Name: 1-[1-(5-ethyl-2-thienyl)-2-(2-pyridyl)ethyl]-1,4-diazepane CAS Name: 1-[1-(5-ethyl-2-thiophenyl)-2-(2-pyridinyl)ethyl]-1,4-diazepane IUPAC Name: 1-[1-(5-ethylthiophen-2-yl)-2-pyridin-2-ylethyl]-1,4-diazepane Traditional Name: 1-[1-(5-ethyl-2-thienyl)-2-(2-pyridyl)ethyl]-1,4-diazepane Formula: C18H25N3S MolecularWeight: 315.4762

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(CC2=CC=CC=N2)N3CCCNCC3

Isomeric SMILES

CCC1=CC=C(S1)C(CC2=CC=CC=N2)N3CCCNCC3

InChI

InChI=1S/C18H25N3S/c1-2-16-7-8-18(22-16)17(14-15-6-3-4-10-20-15)21-12-5-9-19-11-13-21/h3-4,6-8,10,17,19H,2,5,9,11-14H2,1H3