2-(pyrimidin-2-ylmethyl)imidazole-1-carbothioate

Systemtic Name: 2-(pyrimidin-2-ylmethyl)imidazole-1-carbothioate Openeye Name: 2-(pyrimidin-2-ylmethyl)imidazole-1-carbothioate CAS Name: 2-(2-pyrimidinylmethyl)-1-imidazolecarbothioate IUPAC Name: 2-(pyrimidin-2-ylmethyl)imidazole-1-carbothioate Traditional Name: 2-(2-pyrimidylmethyl)imidazole-1-carbothioate Formula: C9H7N4OS- MolecularWeight: 219.24308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)CC2=NC=CN2C(=S)[O-]

Isomeric SMILES

C1=CN=C(N=C1)CC2=NC=CN2C(=S)[O-]

InChI

InChI=1S/C9H8N4OS/c14-9(15)13-5-4-12-8(13)6-7-10-2-1-3-11-7/h1-5H,6H2,(H,14,15)/p-1