(2-pyridin-2-ylsulfanylcycloheptyl)methanamine

Systemtic Name: (2-pyridin-2-ylsulfanylcycloheptyl)methanamine Openeye Name: [2-(2-pyridylsulfanyl)cycloheptyl]methanamine CAS Name: [2-(2-pyridinylthio)cycloheptyl]methanamine IUPAC Name: (2-pyridin-2-ylsulfanylcycloheptyl)methanamine Traditional Name: [2-(2-pyridylthio)cycloheptyl]methylamine Formula: C13H20N2S MolecularWeight: 236.3763

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(CC1)SC2=CC=CC=N2)CN

Isomeric SMILES

C1CCC(C(CC1)SC2=CC=CC=N2)CN

InChI

InChI=1S/C13H20N2S/c14-10-11-6-2-1-3-7-12(11)16-13-8-4-5-9-15-13/h4-5,8-9,11-12H,1-3,6-7,10,14H2