2-(6-methyl-4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylethanoate

Systemtic Name: 2-(6-methyl-4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylethanoate Openeye Name: 2-(6-methyl-4-oxo-3-phenyl-quinazolin-2-yl)sulfanylacetate CAS Name: 2-[(6-methyl-4-oxo-3-phenyl-2-quinazolinyl)thio]acetate IUPAC Name: 2-(6-methyl-4-oxo-3-phenylquinazolin-2-yl)sulfanylacetate Traditional Name: 2-[(4-keto-6-methyl-3-phenyl-quinazolin-2-yl)thio]acetate Formula: C17H13N2O3S- MolecularWeight: 325.36172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N(C2=O)C3=CC=CC=C3)SCC(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N(C2=O)C3=CC=CC=C3)SCC(=O)[O-]

InChI

InChI=1S/C17H14N2O3S/c1-11-7-8-14-13(9-11)16(22)19(12-5-3-2-4-6-12)17(18-14)23-10-15(20)21/h2-9H,10H2,1H3,(H,20,21)/p-1