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

Systemtic Name: 2-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-5,6-dimethyl-3-(phenylmethyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-benzyl-2-[(7-methoxy-2-oxo-chromen-4-yl)methylsulfanyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methylthio]-5,6-dimethyl-3-(phenylmethyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-benzyl-2-[(7-methoxy-2-oxochromen-4-yl)methylsulfanyl]-5,6-dimethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-benzyl-2-[(2-keto-7-methoxy-chromen-4-yl)methylthio]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C26H22N2O4S2 MolecularWeight: 490.59388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCC3=CC(=O)OC4=C3C=CC(=C4)OC)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCC3=CC(=O)OC4=C3C=CC(=C4)OC)CC5=CC=CC=C5)C

InChI

InChI=1S/C26H22N2O4S2/c1-15-16(2)34-24-23(15)25(30)28(13-17-7-5-4-6-8-17)26(27-24)33-14-18-11-22(29)32-21-12-19(31-3)9-10-20(18)21/h4-12H,13-14H2,1-3H3