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

Systemtic Name: 2-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylsulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(7-methoxy-2-oxo-chromen-4-yl)methylsulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(7-methoxy-2-oxo-1-benzopyran-4-yl)methylthio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(7-methoxy-2-oxochromen-4-yl)methylsulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(2-keto-7-methoxy-chromen-4-yl)methylthio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C20H18N2O4S2 MolecularWeight: 414.49792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSCC3=CC(=O)OC4=C3C=CC(=C4)OC)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSCC3=CC(=O)OC4=C3C=CC(=C4)OC)C

InChI

InChI=1S/C20H18N2O4S2/c1-10-11(2)28-20-18(10)19(24)21-16(22-20)9-27-8-12-6-17(23)26-15-7-13(25-3)4-5-14(12)15/h4-7H,8-9H2,1-3H3,(H,21,22,24)