1-pentylsulfanyl-4-pyridin-3-yl-1,4-diazepane

Systemtic Name: 1-pentylsulfanyl-4-pyridin-3-yl-1,4-diazepane Openeye Name: 1-pentylsulfanyl-4-(3-pyridyl)-1,4-diazepane CAS Name: 1-(pentylthio)-4-(3-pyridinyl)-1,4-diazepane IUPAC Name: 1-pentylsulfanyl-4-pyridin-3-yl-1,4-diazepane Traditional Name: 1-(amylthio)-4-(3-pyridyl)-1,4-diazepane Formula: C15H25N3S MolecularWeight: 279.4441

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSN1CCCN(CC1)C2=CN=CC=C2

Isomeric SMILES

CCCCCSN1CCCN(CC1)C2=CN=CC=C2

InChI

InChI=1S/C15H25N3S/c1-2-3-4-13-19-18-10-6-9-17(11-12-18)15-7-5-8-16-14-15/h5,7-8,14H,2-4,6,9-13H2,1H3