2-[4-(2,6-dimethylphenoxy)butylamino]ethanethiol

Systemtic Name: 2-[4-(2,6-dimethylphenoxy)butylamino]ethanethiol Openeye Name: 2-[4-(2,6-dimethylphenoxy)butylamino]ethanethiol CAS Name: 2-[4-(2,6-dimethylphenoxy)butylamino]ethanethiol IUPAC Name: 2-[4-(2,6-dimethylphenoxy)butylamino]ethanethiol Traditional Name: 2-[4-(2,6-dimethylphenoxy)butylamino]ethanethiol Formula: C14H23NOS MolecularWeight: 253.40352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCCCNCCS

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCCCNCCS

InChI

InChI=1S/C14H23NOS/c1-12-6-5-7-13(2)14(12)16-10-4-3-8-15-9-11-17/h5-7,15,17H,3-4,8-11H2,1-2H3