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

Systemtic Name: 1-[5-(2-methylsulfanylethoxy)pyridin-3-yl]-1,4-diazepane Openeye Name: 1-[5-(2-methylsulfanylethoxy)-3-pyridyl]-1,4-diazepane CAS Name: 1-[5-[2-(methylthio)ethoxy]-3-pyridinyl]-1,4-diazepane IUPAC Name: 1-[5-(2-methylsulfanylethoxy)pyridin-3-yl]-1,4-diazepane Traditional Name: 1-[5-[2-(methylthio)ethoxy]-3-pyridyl]-1,4-diazepane Formula: C13H21N3OS MolecularWeight: 267.39034

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Descriptors Computed from Structure

Canonical SMILES:

CSCCOC1=CN=CC(=C1)N2CCCNCC2

Isomeric SMILES

CSCCOC1=CN=CC(=C1)N2CCCNCC2

InChI

InChI=1S/C13H21N3OS/c1-18-8-7-17-13-9-12(10-15-11-13)16-5-2-3-14-4-6-16/h9-11,14H,2-8H2,1H3