[(1S)-1-(4-pyrimidin-2-ylsulfanylphenyl)ethyl]azanium

Systemtic Name: [(1S)-1-(4-pyrimidin-2-ylsulfanylphenyl)ethyl]azanium Openeye Name: [(1S)-1-(4-pyrimidin-2-ylsulfanylphenyl)ethyl]ammonium CAS Name: [(1S)-1-[4-(2-pyrimidinylthio)phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-(4-pyrimidin-2-ylsulfanylphenyl)ethyl]azanium Traditional Name: [(1S)-1-[4-(2-pyrimidylthio)phenyl]ethyl]ammonium Formula: C12H14N3S+ MolecularWeight: 232.32466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)SC2=NC=CC=N2)[NH3+]

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)SC2=NC=CC=N2)[NH3+]

InChI

InChI=1S/C12H13N3S/c1-9(13)10-3-5-11(6-4-10)16-12-14-7-2-8-15-12/h2-9H,13H2,1H3/p+1/t9-/m0/s1