6-[2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoyl]-4-propyl-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoyl]-4-propyl-1,4-benzoxazin-3-one Openeye Name: 6-[2-(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetyl]-4-propyl-1,4-benzoxazin-3-one CAS Name: 6-[1-oxo-2-(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)ethyl]-4-propyl-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)acetyl]-4-propyl-1,4-benzoxazin-3-one Traditional Name: 6-[2-(4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetyl]-4-propyl-1,4-benzoxazin-3-one Formula: C25H21N3O4S MolecularWeight: 459.51694

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)COC2=C1C=C(C=C2)C(=O)CN3C=NC4=C(C3=O)C(=CS4)C5=CC=CC=C5

Isomeric SMILES

CCCN1C(=O)COC2=C1C=C(C=C2)C(=O)CN3C=NC4=C(C3=O)C(=CS4)C5=CC=CC=C5

InChI

InChI=1S/C25H21N3O4S/c1-2-10-28-19-11-17(8-9-21(19)32-13-22(28)30)20(29)12-27-15-26-24-23(25(27)31)18(14-33-24)16-6-4-3-5-7-16/h3-9,11,14-15H,2,10,12-13H2,1H3