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

Systemtic Name: 5-cyclopropyl-2-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-cyclopropyl-2-[(7-hydroxy-2-oxo-chromen-4-yl)methylsulfanyl]-3-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-cyclopropyl-2-[(7-hydroxy-2-oxo-1-benzopyran-4-yl)methylthio]-3-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-cyclopropyl-2-[(7-hydroxy-2-oxochromen-4-yl)methylsulfanyl]-3-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 5-cyclopropyl-2-[(7-hydroxy-2-keto-chromen-4-yl)methylthio]-3-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C25H18N2O4S2 MolecularWeight: 474.55142

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CSC3=C2C(=O)N(C(=N3)SCC4=CC(=O)OC5=C4C=CC(=C5)O)C6=CC=CC=C6

Isomeric SMILES

C1CC1C2=CSC3=C2C(=O)N(C(=N3)SCC4=CC(=O)OC5=C4C=CC(=C5)O)C6=CC=CC=C6

InChI

InChI=1S/C25H18N2O4S2/c28-17-8-9-18-15(10-21(29)31-20(18)11-17)12-33-25-26-23-22(19(13-32-23)14-6-7-14)24(30)27(25)16-4-2-1-3-5-16/h1-5,8-11,13-14,28H,6-7,12H2