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

Systemtic Name: 2-[2-oxidanylidene-2-[[2-(phenylmethyl)phenyl]amino]ethyl]sulfanylquinazolin-4-olate Openeye Name: 2-[2-(2-benzylanilino)-2-oxo-ethyl]sulfanylquinazolin-4-olate CAS Name: 2-[[2-oxo-2-[2-(phenylmethyl)anilino]ethyl]thio]-4-quinazolinolate IUPAC Name: 2-[2-(2-benzylanilino)-2-oxoethyl]sulfanylquinazolin-4-olate Traditional Name: 2-[[2-(2-benzylanilino)-2-keto-ethyl]thio]quinazolin-4-olate Formula: C23H18N3O2S- MolecularWeight: 400.47292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)CSC3=NC4=CC=CC=C4C(=N3)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)CSC3=NC4=CC=CC=C4C(=N3)[O-]

InChI

InChI=1S/C23H19N3O2S/c27-21(15-29-23-25-20-13-7-5-11-18(20)22(28)26-23)24-19-12-6-4-10-17(19)14-16-8-2-1-3-9-16/h1-13H,14-15H2,(H,24,27)(H,25,26,28)/p-1