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

Systemtic Name: 1-[(5-ethylthiophen-2-yl)-pyridin-2-yl-methyl]-1,4-diazepane Openeye Name: 1-[(5-ethyl-2-thienyl)-(2-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(5-ethyl-2-thiophenyl)-(2-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-ethylthiophen-2-yl)-pyridin-2-ylmethyl]-1,4-diazepane Traditional Name: 1-[(5-ethyl-2-thienyl)-(2-pyridyl)methyl]-1,4-diazepane Formula: C17H23N3S MolecularWeight: 301.44962

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(C2=CC=CC=N2)N3CCCNCC3

Isomeric SMILES

CCC1=CC=C(S1)C(C2=CC=CC=N2)N3CCCNCC3

InChI

InChI=1S/C17H23N3S/c1-2-14-7-8-16(21-14)17(15-6-3-4-10-19-15)20-12-5-9-18-11-13-20/h3-4,6-8,10,17-18H,2,5,9,11-13H2,1H3