zinc 3-phenyl-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: zinc 3-phenyl-2-sulfanylidene-quinazolin-4-olate Openeye Name: zinc 3-phenyl-2-thioxo-quinazolin-4-olate CAS Name: zinc 3-phenyl-2-sulfanylidene-4-quinazolinolate IUPAC Name: zinc 3-phenyl-2-sulfanylidenequinazolin-4-olate Traditional Name: zinc 3-phenyl-2-thioxo-quinazolin-4-olate Formula: C28H18N4O2S2Zn MolecularWeight: 572.00712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C3C=CC=CC3=NC2=S)[O-].C1=CC=C(C=C1)N2C(=C3C=CC=CC3=NC2=S)[O-].[Zn+2]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C3C=CC=CC3=NC2=S)[O-].C1=CC=C(C=C1)N2C(=C3C=CC=CC3=NC2=S)[O-].[Zn+2]

InChI

InChI=1S/2C14H10N2OS.Zn/c2*17-13-11-8-4-5-9-12(11)15-14(18)16(13)10-6-2-1-3-7-10;/h2*1-9,17H;/q;;+2/p-2