(4-tert-butyl-2-pyridin-2-ylsulfanyl-cyclohexyl)methanamine

Systemtic Name: (4-tert-butyl-2-pyridin-2-ylsulfanyl-cyclohexyl)methanamine Openeye Name: [4-tert-butyl-2-(2-pyridylsulfanyl)cyclohexyl]methanamine CAS Name: [4-tert-butyl-2-(2-pyridinylthio)cyclohexyl]methanamine IUPAC Name: (4-tert-butyl-2-pyridin-2-ylsulfanylcyclohexyl)methanamine Traditional Name: [4-tert-butyl-2-(2-pyridylthio)cyclohexyl]methylamine Formula: C16H26N2S MolecularWeight: 278.45604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(C(C1)SC2=CC=CC=N2)CN

Isomeric SMILES

CC(C)(C)C1CCC(C(C1)SC2=CC=CC=N2)CN

InChI

InChI=1S/C16H26N2S/c1-16(2,3)13-8-7-12(11-17)14(10-13)19-15-6-4-5-9-18-15/h4-6,9,12-14H,7-8,10-11,17H2,1-3H3