[2-(2-pyrimidin-2-ylsulfanylethoxy)phenyl]methanamine

Systemtic Name: [2-(2-pyrimidin-2-ylsulfanylethoxy)phenyl]methanamine Openeye Name: [2-(2-pyrimidin-2-ylsulfanylethoxy)phenyl]methanamine CAS Name: [2-[2-(2-pyrimidinylthio)ethoxy]phenyl]methanamine IUPAC Name: [2-(2-pyrimidin-2-ylsulfanylethoxy)phenyl]methanamine Traditional Name: [2-[2-(2-pyrimidylthio)ethoxy]benzyl]amine Formula: C13H15N3OS MolecularWeight: 261.3427

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN)OCCSC2=NC=CC=N2

Isomeric SMILES

C1=CC=C(C(=C1)CN)OCCSC2=NC=CC=N2

InChI

InChI=1S/C13H15N3OS/c14-10-11-4-1-2-5-12(11)17-8-9-18-13-15-6-3-7-16-13/h1-7H,8-10,14H2