1-(6-ethylsulfanylpyridin-3-yl)-1,4-diazepane

Systemtic Name: 1-(6-ethylsulfanylpyridin-3-yl)-1,4-diazepane Openeye Name: 1-(6-ethylsulfanyl-3-pyridyl)-1,4-diazepane CAS Name: 1-[6-(ethylthio)-3-pyridinyl]-1,4-diazepane IUPAC Name: 1-(6-ethylsulfanylpyridin-3-yl)-1,4-diazepane Traditional Name: 1-[6-(ethylthio)-3-pyridyl]-1,4-diazepane Formula: C12H19N3S MolecularWeight: 237.36436

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C(C=C1)N2CCCNCC2

Isomeric SMILES

CCSC1=NC=C(C=C1)N2CCCNCC2

InChI

InChI=1S/C12H19N3S/c1-2-16-12-5-4-11(10-14-12)15-8-3-6-13-7-9-15/h4-5,10,13H,2-3,6-9H2,1H3