3-[(2,5-dimethylphenyl)sulfanylmethyl]-4-methoxy-aniline

Systemtic Name: 3-[(2,5-dimethylphenyl)sulfanylmethyl]-4-methoxy-aniline Openeye Name: 3-[(2,5-dimethylphenyl)sulfanylmethyl]-4-methoxy-aniline CAS Name: 3-[[(2,5-dimethylphenyl)thio]methyl]-4-methoxyaniline IUPAC Name: 3-[(2,5-dimethylphenyl)sulfanylmethyl]-4-methoxyaniline Traditional Name: [3-[[(2,5-dimethylphenyl)thio]methyl]-4-methoxy-phenyl]amine Formula: C16H19NOS MolecularWeight: 273.39316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC2=C(C=CC(=C2)N)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC2=C(C=CC(=C2)N)OC

InChI

InChI=1S/C16H19NOS/c1-11-4-5-12(2)16(8-11)19-10-13-9-14(17)6-7-15(13)18-3/h4-9H,10,17H2,1-3H3