2-(4-azanylheptan-3-yl)benzenethiol

Systemtic Name: 2-(4-azanylheptan-3-yl)benzenethiol Openeye Name: 2-(2-amino-1-ethyl-pentyl)benzenethiol CAS Name: 2-(4-aminoheptan-3-yl)benzenethiol IUPAC Name: 2-(4-aminoheptan-3-yl)benzenethiol Traditional Name: 2-(2-amino-1-ethyl-pentyl)benzenethiol Formula: C13H21NS MolecularWeight: 223.37754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC)C1=CC=CC=C1S)N

Isomeric SMILES

CCCC(C(CC)C1=CC=CC=C1S)N

InChI

InChI=1S/C13H21NS/c1-3-7-12(14)10(4-2)11-8-5-6-9-13(11)15/h5-6,8-10,12,15H,3-4,7,14H2,1-2H3