2-[(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(7,8-dimethyl-2-oxo-chromen-4-yl)methylsulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methylthio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(7,8-dimethyl-2-oxochromen-4-yl)methylsulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(2-keto-7,8-dimethyl-chromen-4-yl)methylthio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H20N2O3S2 MolecularWeight: 412.5251

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CSCC3=NC4=C(C(=C(S4)C)C)C(=O)N3)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CSCC3=NC4=C(C(=C(S4)C)C)C(=O)N3)C

InChI

InChI=1S/C21H20N2O3S2/c1-10-5-6-15-14(7-17(24)26-19(15)11(10)2)8-27-9-16-22-20(25)18-12(3)13(4)28-21(18)23-16/h5-7H,8-9H2,1-4H3,(H,22,23,25)