2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-ethyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-ethyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(6,7-dimethyl-2-oxo-chromen-4-yl)methylsulfanyl]-3-ethyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methylthio]-3-ethyl-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(6,7-dimethyl-2-oxochromen-4-yl)methylsulfanyl]-3-ethyl-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-ethyl-2-[(2-keto-6,7-dimethyl-chromen-4-yl)methylthio]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C26H22N2O3S2 MolecularWeight: 474.59448

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SCC3=CC(=O)OC4=CC(=C(C=C34)C)C)SC=C2C5=CC=CC=C5

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SCC3=CC(=O)OC4=CC(=C(C=C34)C)C)SC=C2C5=CC=CC=C5

InChI

InChI=1S/C26H22N2O3S2/c1-4-28-25(30)23-20(17-8-6-5-7-9-17)14-32-24(23)27-26(28)33-13-18-12-22(29)31-21-11-16(3)15(2)10-19(18)21/h5-12,14H,4,13H2,1-3H3