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

Systemtic Name: 5,6-dimethyl-2-[(7-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-[(7-methyl-2-oxo-chromen-4-yl)methylsulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[[(7-methyl-2-oxo-1-benzopyran-4-yl)methylthio]methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-[(7-methyl-2-oxochromen-4-yl)methylsulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(2-keto-7-methyl-chromen-4-yl)methylthio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C20H18N2O3S2 MolecularWeight: 398.49852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSCC3=NC4=C(C(=C(S4)C)C)C(=O)N3

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSCC3=NC4=C(C(=C(S4)C)C)C(=O)N3

InChI

InChI=1S/C20H18N2O3S2/c1-10-4-5-14-13(7-17(23)25-15(14)6-10)8-26-9-16-21-19(24)18-11(2)12(3)27-20(18)22-16/h4-7H,8-9H2,1-3H3,(H,21,22,24)