3-[(4-methoxyphenyl)methyl]-6-(phenylmethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-6-(phenylmethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-benzyl-3-[(4-methoxyphenyl)methyl]-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(4-methoxyphenyl)methyl]-6-(phenylmethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-benzyl-3-[(4-methoxyphenyl)methyl]-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-benzyl-3-p-anisyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C21H18N2O2S2 MolecularWeight: 394.50982

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=O)C3=C(NC2=S)SC(=C3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=O)C3=C(NC2=S)SC(=C3)CC4=CC=CC=C4

InChI

InChI=1S/C21H18N2O2S2/c1-25-16-9-7-15(8-10-16)13-23-20(24)18-12-17(27-19(18)22-21(23)26)11-14-5-3-2-4-6-14/h2-10,12H,11,13H2,1H3,(H,22,26)