N-(4-ethanoylphenyl)-2-(4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-ethanoylphenyl)-2-(4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-acetylphenyl)-2-(4-oxo-3-phenethyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(4-acetylphenyl)-2-[(4-oxo-3-phenethyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-(4-acetylphenyl)-2-(4-oxo-3-phenethylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(4-acetylphenyl)-2-[(4-keto-3-phenethyl-quinazolin-2-yl)thio]acetamide Formula: C26H23N3O3S MolecularWeight: 457.54412

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=CC=C4

InChI

InChI=1S/C26H23N3O3S/c1-18(30)20-11-13-21(14-12-20)27-24(31)17-33-26-28-23-10-6-5-9-22(23)25(32)29(26)16-15-19-7-3-2-4-8-19/h2-14H,15-17H2,1H3,(H,27,31)