5-(1-benzothiophen-3-yl)-2,4-bis(oxidanylidene)-1H-pyrimidin-6-olate

Systemtic Name: 5-(1-benzothiophen-3-yl)-2,4-bis(oxidanylidene)-1H-pyrimidin-6-olate Openeye Name: 5-(benzothiophen-3-yl)-2,4-dioxo-1H-pyrimidin-6-olate CAS Name: 5-(1-benzothiophen-3-yl)-2,4-dioxo-1H-pyrimidin-6-olate IUPAC Name: 5-(1-benzothiophen-3-yl)-2,4-dioxo-1H-pyrimidin-6-olate Traditional Name: 5-(benzothiophen-3-yl)-2,4-diketo-1H-pyrimidin-6-olate Formula: C12H7N2O3S- MolecularWeight: 259.26058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CS2)C3=C(NC(=O)NC3=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CS2)C3=C(NC(=O)NC3=O)[O-]

InChI

InChI=1S/C12H8N2O3S/c15-10-9(11(16)14-12(17)13-10)7-5-18-8-4-2-1-3-6(7)8/h1-5H,(H3,13,14,15,16,17)/p-1