2-[2-oxidanylidene-2-[(4-phenoxyphenyl)amino]ethyl]sulfanylquinazolin-4-olate

Systemtic Name: 2-[2-oxidanylidene-2-[(4-phenoxyphenyl)amino]ethyl]sulfanylquinazolin-4-olate Openeye Name: 2-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanylquinazolin-4-olate CAS Name: 2-[[2-oxo-2-(4-phenoxyanilino)ethyl]thio]-4-quinazolinolate IUPAC Name: 2-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanylquinazolin-4-olate Traditional Name: 2-[[2-keto-2-(4-phenoxyanilino)ethyl]thio]quinazolin-4-olate Formula: C22H16N3O3S- MolecularWeight: 402.44574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4C(=N3)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4C(=N3)[O-]

InChI

InChI=1S/C22H17N3O3S/c26-20(14-29-22-24-19-9-5-4-8-18(19)21(27)25-22)23-15-10-12-17(13-11-15)28-16-6-2-1-3-7-16/h1-13H,14H2,(H,23,26)(H,24,25,27)/p-1