N-[(3,5-dimethoxyphenyl)methyl]-3-phenylsulfanyl-propan-1-amine

Systemtic Name: N-[(3,5-dimethoxyphenyl)methyl]-3-phenylsulfanyl-propan-1-amine Openeye Name: N-[(3,5-dimethoxyphenyl)methyl]-3-phenylsulfanyl-propan-1-amine CAS Name: N-[(3,5-dimethoxyphenyl)methyl]-3-(phenylthio)-1-propanamine IUPAC Name: N-[(3,5-dimethoxyphenyl)methyl]-3-phenylsulfanylpropan-1-amine Traditional Name: (3,5-dimethoxybenzyl)-[3-(phenylthio)propyl]amine Formula: C18H23NO2S MolecularWeight: 317.44572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CNCCCSC2=CC=CC=C2)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CNCCCSC2=CC=CC=C2)OC

InChI

InChI=1S/C18H23NO2S/c1-20-16-11-15(12-17(13-16)21-2)14-19-9-6-10-22-18-7-4-3-5-8-18/h3-5,7-8,11-13,19H,6,9-10,14H2,1-2H3