3-methyl-2-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-methyl-2-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(7-hydroxy-2-oxo-chromen-4-yl)methylsulfanyl]-3-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(7-hydroxy-2-oxo-1-benzopyran-4-yl)methylthio]-3-methyl-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(7-hydroxy-2-oxochromen-4-yl)methylsulfanyl]-3-methyl-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(7-hydroxy-2-keto-chromen-4-yl)methylthio]-3-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C23H16N2O4S2 MolecularWeight: 448.51414

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCC3=CC(=O)OC4=C3C=CC(=C4)O)SC=C2C5=CC=CC=C5

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCC3=CC(=O)OC4=C3C=CC(=C4)O)SC=C2C5=CC=CC=C5

InChI

InChI=1S/C23H16N2O4S2/c1-25-22(28)20-17(13-5-3-2-4-6-13)12-30-21(20)24-23(25)31-11-14-9-19(27)29-18-10-15(26)7-8-16(14)18/h2-10,12,26H,11H2,1H3