2-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-(phenylmethyl)thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-(phenylmethyl)thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-benzyl-2-[(7-hydroxy-2-oxo-chromen-4-yl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[(7-hydroxy-2-oxo-1-benzopyran-4-yl)methylthio]-3-(phenylmethyl)-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-benzyl-2-[(7-hydroxy-2-oxochromen-4-yl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one Traditional Name: 3-benzyl-2-[(7-hydroxy-2-keto-chromen-4-yl)methylthio]thieno[3,2-d]pyrimidin-4-one Formula: C23H16N2O4S2 MolecularWeight: 448.51414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CS3)N=C2SCC4=CC(=O)OC5=C4C=CC(=C5)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CS3)N=C2SCC4=CC(=O)OC5=C4C=CC(=C5)O

InChI

InChI=1S/C23H16N2O4S2/c26-16-6-7-17-15(10-20(27)29-19(17)11-16)13-31-23-24-18-8-9-30-21(18)22(28)25(23)12-14-4-2-1-3-5-14/h1-11,26H,12-13H2