4-[2-(3,4-dimethylphenyl)sulfanylethyl]aniline

Systemtic Name: 4-[2-(3,4-dimethylphenyl)sulfanylethyl]aniline Openeye Name: 4-[2-(3,4-dimethylphenyl)sulfanylethyl]aniline CAS Name: 4-[2-[(3,4-dimethylphenyl)thio]ethyl]aniline IUPAC Name: 4-[2-(3,4-dimethylphenyl)sulfanylethyl]aniline Traditional Name: [4-[2-[(3,4-dimethylphenyl)thio]ethyl]phenyl]amine Formula: C16H19NS MolecularWeight: 257.39376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCC2=CC=C(C=C2)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCC2=CC=C(C=C2)N)C

InChI

InChI=1S/C16H19NS/c1-12-3-8-16(11-13(12)2)18-10-9-14-4-6-15(17)7-5-14/h3-8,11H,9-10,17H2,1-2H3