N-(4-ethanoylphenyl)-2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-ethanoylphenyl)-2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-acetylphenyl)-2-(3-benzyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(4-acetylphenyl)-2-[[4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]acetamide IUPAC Name: N-(4-acetylphenyl)-2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(4-acetylphenyl)-2-[(3-benzyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C25H21N3O3S MolecularWeight: 443.51754

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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)N2CC4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4

InChI

InChI=1S/C25H21N3O3S/c1-17(29)19-11-13-20(14-12-19)26-23(30)16-32-25-27-22-10-6-5-9-21(22)24(31)28(25)15-18-7-3-2-4-8-18/h2-14H,15-16H2,1H3,(H,26,30)