1-[(5-ethylthiophen-2-yl)-pyridin-3-yl-methyl]-1,4-diazepane

Systemtic Name: 1-[(5-ethylthiophen-2-yl)-pyridin-3-yl-methyl]-1,4-diazepane Openeye Name: 1-[(5-ethyl-2-thienyl)-(3-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(5-ethyl-2-thiophenyl)-(3-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-ethylthiophen-2-yl)-pyridin-3-ylmethyl]-1,4-diazepane Traditional Name: 1-[(5-ethyl-2-thienyl)-(3-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=CN=CC=C2)N3CCCNCC3

Isomeric SMILES

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

InChI

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