6-[2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[1-oxo-2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]propyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]propanoyl]-4H-1,4-benzoxazin-3-one Formula: C25H19N3O4S MolecularWeight: 457.50106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(C=C1)OCC(=O)N2)SC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5

Isomeric SMILES

CC(C(=O)C1=CC2=C(C=C1)OCC(=O)N2)SC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5

InChI

InChI=1S/C25H19N3O4S/c1-15(23(30)16-11-12-21-20(13-16)26-22(29)14-32-21)33-25-27-19-10-6-5-9-18(19)24(31)28(25)17-7-3-2-4-8-17/h2-13,15H,14H2,1H3,(H,26,29)