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

Systemtic Name: 3-ethyl-5,6-dimethyl-2-[(7-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-ethyl-5,6-dimethyl-2-[(7-methyl-2-oxo-chromen-4-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-ethyl-5,6-dimethyl-2-[(7-methyl-2-oxo-1-benzopyran-4-yl)methylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-ethyl-5,6-dimethyl-2-[(7-methyl-2-oxochromen-4-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-ethyl-2-[(2-keto-7-methyl-chromen-4-yl)methylthio]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H20N2O3S2 MolecularWeight: 412.5251

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SCC3=CC(=O)OC4=C3C=CC(=C4)C)SC(=C2C)C

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SCC3=CC(=O)OC4=C3C=CC(=C4)C)SC(=C2C)C

InChI

InChI=1S/C21H20N2O3S2/c1-5-23-20(25)18-12(3)13(4)28-19(18)22-21(23)27-10-14-9-17(24)26-16-8-11(2)6-7-15(14)16/h6-9H,5,10H2,1-4H3