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

Systemtic Name: 2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylquinazolin-4-olate Openeye Name: 2-[2-(4-chloroanilino)-2-oxo-ethyl]sulfanylquinazolin-4-olate CAS Name: 2-[[2-(4-chloroanilino)-2-oxoethyl]thio]-4-quinazolinolate IUPAC Name: 2-[2-(4-chloroanilino)-2-oxoethyl]sulfanylquinazolin-4-olate Traditional Name: 2-[[2-(4-chloroanilino)-2-keto-ethyl]thio]quinazolin-4-olate Formula: C16H11ClN3O2S- MolecularWeight: 344.79544

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)SCC(=O)NC3=CC=C(C=C3)Cl)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)SCC(=O)NC3=CC=C(C=C3)Cl)[O-]

InChI

InChI=1S/C16H12ClN3O2S/c17-10-5-7-11(8-6-10)18-14(21)9-23-16-19-13-4-2-1-3-12(13)15(22)20-16/h1-8H,9H2,(H,18,21)(H,19,20,22)/p-1