[3-[2-(3,4-dimethylphenyl)sulfanylethoxy]phenyl]methanamine

Systemtic Name: [3-[2-(3,4-dimethylphenyl)sulfanylethoxy]phenyl]methanamine Openeye Name: [3-[2-(3,4-dimethylphenyl)sulfanylethoxy]phenyl]methanamine CAS Name: [3-[2-[(3,4-dimethylphenyl)thio]ethoxy]phenyl]methanamine IUPAC Name: [3-[2-(3,4-dimethylphenyl)sulfanylethoxy]phenyl]methanamine Traditional Name: [3-[2-[(3,4-dimethylphenyl)thio]ethoxy]benzyl]amine Formula: C17H21NOS MolecularWeight: 287.41974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCOC2=CC=CC(=C2)CN)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCOC2=CC=CC(=C2)CN)C

InChI

InChI=1S/C17H21NOS/c1-13-6-7-17(10-14(13)2)20-9-8-19-16-5-3-4-15(11-16)12-18/h3-7,10-11H,8-9,12,18H2,1-2H3