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

Systemtic Name: 1-butylsulfanyl-4-pyridin-3-yl-1,4-diazepane Openeye Name: 1-butylsulfanyl-4-(3-pyridyl)-1,4-diazepane CAS Name: 1-(butylthio)-4-(3-pyridinyl)-1,4-diazepane IUPAC Name: 1-butylsulfanyl-4-pyridin-3-yl-1,4-diazepane Traditional Name: 1-(butylthio)-4-(3-pyridyl)-1,4-diazepane Formula: C14H23N3S MolecularWeight: 265.41752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSN1CCCN(CC1)C2=CN=CC=C2

Isomeric SMILES

CCCCSN1CCCN(CC1)C2=CN=CC=C2

InChI

InChI=1S/C14H23N3S/c1-2-3-12-18-17-9-5-8-16(10-11-17)14-6-4-7-15-13-14/h4,6-7,13H,2-3,5,8-12H2,1H3