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

Systemtic Name: 1-propylsulfanyl-4-pyridin-3-yl-1,4-diazepane Openeye Name: 1-propylsulfanyl-4-(3-pyridyl)-1,4-diazepane CAS Name: 1-(propylthio)-4-(3-pyridinyl)-1,4-diazepane IUPAC Name: 1-propylsulfanyl-4-pyridin-3-yl-1,4-diazepane Traditional Name: 1-(propylthio)-4-(3-pyridyl)-1,4-diazepane Formula: C13H21N3S MolecularWeight: 251.39094

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Descriptors Computed from Structure

Canonical SMILES:

CCCSN1CCCN(CC1)C2=CN=CC=C2

Isomeric SMILES

CCCSN1CCCN(CC1)C2=CN=CC=C2

InChI

InChI=1S/C13H21N3S/c1-2-11-17-16-8-4-7-15(9-10-16)13-5-3-6-14-12-13/h3,5-6,12H,2,4,7-11H2,1H3