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

Systemtic Name: 4-[3-(2,4-dimethylphenyl)sulfanylpropoxy]aniline Openeye Name: 4-[3-(2,4-dimethylphenyl)sulfanylpropoxy]aniline CAS Name: 4-[3-[(2,4-dimethylphenyl)thio]propoxy]aniline IUPAC Name: 4-[3-(2,4-dimethylphenyl)sulfanylpropoxy]aniline Traditional Name: [4-[3-[(2,4-dimethylphenyl)thio]propoxy]phenyl]amine Formula: C17H21NOS MolecularWeight: 287.41974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCCCOC2=CC=C(C=C2)N)C

Isomeric SMILES

CC1=CC(=C(C=C1)SCCCOC2=CC=C(C=C2)N)C

InChI

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