1-oxidanidyl-4-(pyridin-3-ylmethylsulfanyl)pyrimidin-1-ium

Systemtic Name: 1-oxidanidyl-4-(pyridin-3-ylmethylsulfanyl)pyrimidin-1-ium Openeye Name: 1-oxido-4-(3-pyridylmethylsulfanyl)pyrimidin-1-ium CAS Name: 1-oxido-4-(3-pyridinylmethylthio)pyrimidin-1-ium IUPAC Name: 1-oxido-4-(pyridin-3-ylmethylsulfanyl)pyrimidin-1-ium Traditional Name: 1-oxido-4-(3-pyridylmethylthio)pyrimidin-1-ium Formula: C10H9N3OS MolecularWeight: 219.26296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CSC2=NC=[N+](C=C2)[O-]

Isomeric SMILES

C1=CC(=CN=C1)CSC2=NC=[N+](C=C2)[O-]

InChI

InChI=1S/C10H9N3OS/c14-13-5-3-10(12-8-13)15-7-9-2-1-4-11-6-9/h1-6,8H,7H2