3-(phenylcarbamoyl)-[1,2]thiazolo[4,3-d]pyrimidin-7-olate

Systemtic Name: 3-(phenylcarbamoyl)-[1,2]thiazolo[4,3-d]pyrimidin-7-olate Openeye Name: 3-(phenylcarbamoyl)isothiazolo[4,3-d]pyrimidin-7-olate CAS Name: 3-[anilino(oxo)methyl]-7-isothiazolo[4,3-d]pyrimidinolate IUPAC Name: 3-(phenylcarbamoyl)-[1,2]thiazolo[4,3-d]pyrimidin-7-olate Traditional Name: 3-(phenylcarbamoyl)isothiazolo[4,3-d]pyrimidin-7-olate Formula: C12H7N4O2S- MolecularWeight: 271.27458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=C3C(=NS2)C(=NC=N3)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=C3C(=NS2)C(=NC=N3)[O-]

InChI

InChI=1S/C12H8N4O2S/c17-11-9-8(13-6-14-11)10(19-16-9)12(18)15-7-4-2-1-3-5-7/h1-6H,(H,15,18)(H,13,14,17)/p-1