4-ethoxy-3-[(phenylmethylsulfanyl)methyl]aniline

Systemtic Name: 4-ethoxy-3-[(phenylmethylsulfanyl)methyl]aniline Openeye Name: 3-(benzylsulfanylmethyl)-4-ethoxy-aniline CAS Name: 4-ethoxy-3-[(phenylmethylthio)methyl]aniline IUPAC Name: 3-(benzylsulfanylmethyl)-4-ethoxyaniline Traditional Name: [3-[(benzylthio)methyl]-4-ethoxy-phenyl]amine Formula: C16H19NOS MolecularWeight: 273.39316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)N)CSCC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C=C(C=C1)N)CSCC2=CC=CC=C2

InChI

InChI=1S/C16H19NOS/c1-2-18-16-9-8-15(17)10-14(16)12-19-11-13-6-4-3-5-7-13/h3-10H,2,11-12,17H2,1H3