2-(6-chloranyl-4-phenyl-quinazolin-2-yl)sulfanylethanoate

Systemtic Name: 2-(6-chloranyl-4-phenyl-quinazolin-2-yl)sulfanylethanoate Openeye Name: 2-(6-chloro-4-phenyl-quinazolin-2-yl)sulfanylacetate CAS Name: 2-[(6-chloro-4-phenyl-2-quinazolinyl)thio]acetate IUPAC Name: 2-(6-chloro-4-phenylquinazolin-2-yl)sulfanylacetate Traditional Name: 2-[(6-chloro-4-phenyl-quinazolin-2-yl)thio]acetate Formula: C16H10ClN2O2S- MolecularWeight: 329.7808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)SCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)SCC(=O)[O-]

InChI

InChI=1S/C16H11ClN2O2S/c17-11-6-7-13-12(8-11)15(10-4-2-1-3-5-10)19-16(18-13)22-9-14(20)21/h1-8H,9H2,(H,20,21)/p-1