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

Systemtic Name: N-(3-ethanoylphenyl)-2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(3-acetylphenyl)-2-(3-benzyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(3-acetylphenyl)-2-[[4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]propanamide IUPAC Name: N-(3-acetylphenyl)-2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(3-acetylphenyl)-2-[(3-benzyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C26H23N3O3S MolecularWeight: 457.54412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(=O)C)SC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)C(=O)C)SC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4

InChI

InChI=1S/C26H23N3O3S/c1-17(30)20-11-8-12-21(15-20)27-24(31)18(2)33-26-28-23-14-7-6-13-22(23)25(32)29(26)16-19-9-4-3-5-10-19/h3-15,18H,16H2,1-2H3,(H,27,31)