3-(2,5-dimethylphenyl)sulfanyl-2-methyl-propan-1-amine

Systemtic Name: 3-(2,5-dimethylphenyl)sulfanyl-2-methyl-propan-1-amine Openeye Name: 3-(2,5-dimethylphenyl)sulfanyl-2-methyl-propan-1-amine CAS Name: 3-[(2,5-dimethylphenyl)thio]-2-methyl-1-propanamine IUPAC Name: 3-(2,5-dimethylphenyl)sulfanyl-2-methylpropan-1-amine Traditional Name: [3-[(2,5-dimethylphenyl)thio]-2-methyl-propyl]amine Formula: C12H19NS MolecularWeight: 209.35096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC(C)CN

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC(C)CN

InChI

InChI=1S/C12H19NS/c1-9-4-5-11(3)12(6-9)14-8-10(2)7-13/h4-6,10H,7-8,13H2,1-3H3