[4-(2-pyrimidin-2-ylsulfanylethoxy)phenyl]methanamine

Systemtic Name: [4-(2-pyrimidin-2-ylsulfanylethoxy)phenyl]methanamine Openeye Name: [4-(2-pyrimidin-2-ylsulfanylethoxy)phenyl]methanamine CAS Name: [4-[2-(2-pyrimidinylthio)ethoxy]phenyl]methanamine IUPAC Name: [4-(2-pyrimidin-2-ylsulfanylethoxy)phenyl]methanamine Traditional Name: [4-[2-(2-pyrimidylthio)ethoxy]benzyl]amine Formula: C13H15N3OS MolecularWeight: 261.3427

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCCOC2=CC=C(C=C2)CN

Isomeric SMILES

C1=CN=C(N=C1)SCCOC2=CC=C(C=C2)CN

InChI

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