N-[(3,5-dimethoxyphenyl)methyl]-2-phenylsulfanyl-ethanamine

Systemtic Name: N-[(3,5-dimethoxyphenyl)methyl]-2-phenylsulfanyl-ethanamine Openeye Name: N-[(3,5-dimethoxyphenyl)methyl]-2-phenylsulfanyl-ethanamine CAS Name: N-[(3,5-dimethoxyphenyl)methyl]-2-(phenylthio)ethanamine IUPAC Name: N-[(3,5-dimethoxyphenyl)methyl]-2-phenylsulfanylethanamine Traditional Name: (3,5-dimethoxybenzyl)-[2-(phenylthio)ethyl]amine Formula: C17H21NO2S MolecularWeight: 303.41914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CNCCSC2=CC=CC=C2)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CNCCSC2=CC=CC=C2)OC

InChI

InChI=1S/C17H21NO2S/c1-19-15-10-14(11-16(12-15)20-2)13-18-8-9-21-17-6-4-3-5-7-17/h3-7,10-12,18H,8-9,13H2,1-2H3