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

Systemtic Name: 3-ethyl-2-[(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-ethyl-2-[(6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methylsulfanyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-ethyl-2-[(6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methylthio]-5,6-dimethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-ethyl-2-[(6-ethyl-7-hydroxy-2-oxochromen-4-yl)methylsulfanyl]-5,6-dimethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-ethyl-2-[(6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methylthio]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H22N2O4S2 MolecularWeight: 442.55108

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC4=C(C(=C(S4)C)C)C(=O)N3CC)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC4=C(C(=C(S4)C)C)C(=O)N3CC)O

InChI

InChI=1S/C22H22N2O4S2/c1-5-13-7-15-14(8-18(26)28-17(15)9-16(13)25)10-29-22-23-20-19(11(3)12(4)30-20)21(27)24(22)6-2/h7-9,25H,5-6,10H2,1-4H3