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

Systemtic Name: 3-[(2,5-dimethylphenyl)sulfanylmethyl]-4-ethoxy-aniline Openeye Name: 3-[(2,5-dimethylphenyl)sulfanylmethyl]-4-ethoxy-aniline CAS Name: 3-[[(2,5-dimethylphenyl)thio]methyl]-4-ethoxyaniline IUPAC Name: 3-[(2,5-dimethylphenyl)sulfanylmethyl]-4-ethoxyaniline Traditional Name: [3-[[(2,5-dimethylphenyl)thio]methyl]-4-ethoxy-phenyl]amine Formula: C17H21NOS MolecularWeight: 287.41974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)N)CSC2=C(C=CC(=C2)C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)N)CSC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C17H21NOS/c1-4-19-16-8-7-15(18)10-14(16)11-20-17-9-12(2)5-6-13(17)3/h5-10H,4,11,18H2,1-3H3