2-[3-(aminomethylsulfanyl)phenoxy]-N-[(5-phenylpyridin-3-yl)methyl]ethanamine

Systemtic Name: 2-[3-(aminomethylsulfanyl)phenoxy]-N-[(5-phenylpyridin-3-yl)methyl]ethanamine Openeye Name: 2-[3-(aminomethylsulfanyl)phenoxy]-N-[(5-phenyl-3-pyridyl)methyl]ethanamine CAS Name: 2-[3-(aminomethylthio)phenoxy]-N-[(5-phenyl-3-pyridinyl)methyl]ethanamine IUPAC Name: 2-[3-(aminomethylsulfanyl)phenoxy]-N-[(5-phenylpyridin-3-yl)methyl]ethanamine Traditional Name: 2-[3-(aminomethylthio)phenoxy]ethyl-[(5-phenyl-3-pyridyl)methyl]amine Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=CN=C2)CNCCOC3=CC(=CC=C3)SCN

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=CN=C2)CNCCOC3=CC(=CC=C3)SCN

InChI

InChI=1S/C21H23N3OS/c22-16-26-21-8-4-7-20(12-21)25-10-9-23-13-17-11-19(15-24-14-17)18-5-2-1-3-6-18/h1-8,11-12,14-15,23H,9-10,13,16,22H2