4-[2-(2,3,6-trimethylphenoxy)ethylsulfanyl]aniline

Systemtic Name: 4-[2-(2,3,6-trimethylphenoxy)ethylsulfanyl]aniline Openeye Name: 4-[2-(2,3,6-trimethylphenoxy)ethylsulfanyl]aniline CAS Name: 4-[2-(2,3,6-trimethylphenoxy)ethylthio]aniline IUPAC Name: 4-[2-(2,3,6-trimethylphenoxy)ethylsulfanyl]aniline Traditional Name: [4-[2-(2,3,6-trimethylphenoxy)ethylthio]phenyl]amine Formula: C17H21NOS MolecularWeight: 287.41974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCCSC2=CC=C(C=C2)N)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OCCSC2=CC=C(C=C2)N)C

InChI

InChI=1S/C17H21NOS/c1-12-4-5-13(2)17(14(12)3)19-10-11-20-16-8-6-15(18)7-9-16/h4-9H,10-11,18H2,1-3H3