2-[4-(2,3,6-trimethylphenoxy)butylamino]ethanethiol

Systemtic Name: 2-[4-(2,3,6-trimethylphenoxy)butylamino]ethanethiol Openeye Name: 2-[4-(2,3,6-trimethylphenoxy)butylamino]ethanethiol CAS Name: 2-[4-(2,3,6-trimethylphenoxy)butylamino]ethanethiol IUPAC Name: 2-[4-(2,3,6-trimethylphenoxy)butylamino]ethanethiol Traditional Name: 2-[4-(2,3,6-trimethylphenoxy)butylamino]ethanethiol Formula: C15H25NOS MolecularWeight: 267.4301

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25NOS/c1-12-6-7-13(2)15(14(12)3)17-10-5-4-8-16-9-11-18/h6-7,16,18H,4-5,8-11H2,1-3H3