6-[2-(4-oxidanylidene-6-phenyl-3-prop-2-enyl-thieno[3,2-d]pyrimidin-2-yl)sulfanylethanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-(4-oxidanylidene-6-phenyl-3-prop-2-enyl-thieno[3,2-d]pyrimidin-2-yl)sulfanylethanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(3-allyl-4-oxo-6-phenyl-thieno[3,2-d]pyrimidin-2-yl)sulfanylacetyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[1-oxo-2-[(4-oxo-6-phenyl-3-prop-2-enyl-2-thieno[3,2-d]pyrimidinyl)thio]ethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(4-oxo-6-phenyl-3-prop-2-enylthieno[3,2-d]pyrimidin-2-yl)sulfanylacetyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-[(3-allyl-4-keto-6-phenyl-thieno[3,2-d]pyrimidin-2-yl)thio]acetyl]-4H-1,4-benzoxazin-3-one Formula: C25H19N3O4S2 MolecularWeight: 489.56606

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(S2)C3=CC=CC=C3)N=C1SCC(=O)C4=CC5=C(C=C4)OCC(=O)N5

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(S2)C3=CC=CC=C3)N=C1SCC(=O)C4=CC5=C(C=C4)OCC(=O)N5

InChI

InChI=1S/C25H19N3O4S2/c1-2-10-28-24(31)23-18(12-21(34-23)15-6-4-3-5-7-15)27-25(28)33-14-19(29)16-8-9-20-17(11-16)26-22(30)13-32-20/h2-9,11-12H,1,10,13-14H2,(H,26,30)