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

Systemtic Name: 6-[2-[(6-methyl-4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]ethanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-[(6-methyl-4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-[(6-methyl-4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)thio]-1-oxoethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-[(6-methyl-4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-[(4-keto-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)thio]acetyl]-4H-1,4-benzoxazin-3-one Formula: C23H17N3O4S2 MolecularWeight: 463.52878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(NC2=O)SCC(=O)C3=CC4=C(C=C3)OCC(=O)N4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=C(S1)N=C(NC2=O)SCC(=O)C3=CC4=C(C=C3)OCC(=O)N4)C5=CC=CC=C5

InChI

InChI=1S/C23H17N3O4S2/c1-12-19(13-5-3-2-4-6-13)20-21(29)25-23(26-22(20)32-12)31-11-16(27)14-7-8-17-15(9-14)24-18(28)10-30-17/h2-9H,10-11H2,1H3,(H,24,28)(H,25,26,29)