2-azanyl-1-heptan-4-yl-cyclohexane-1-thiol

Systemtic Name: 2-azanyl-1-heptan-4-yl-cyclohexane-1-thiol Openeye Name: 2-amino-1-(1-propylbutyl)cyclohexanethiol CAS Name: 2-amino-1-heptan-4-yl-1-cyclohexanethiol IUPAC Name: 2-amino-1-heptan-4-ylcyclohexane-1-thiol Traditional Name: 2-amino-1-(1-propylbutyl)cyclohexanethiol Formula: C13H27NS MolecularWeight: 229.42518

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C1(CCCCC1N)S

Isomeric SMILES

CCCC(CCC)C1(CCCCC1N)S

InChI

InChI=1S/C13H27NS/c1-3-7-11(8-4-2)13(15)10-6-5-9-12(13)14/h11-12,15H,3-10,14H2,1-2H3