5-ethyl-6-methyl-3-(4-phenylmethoxyphenyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-ethyl-6-methyl-3-(4-phenylmethoxyphenyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(4-benzyloxyphenyl)-5-ethyl-6-methyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-ethyl-6-methyl-3-(4-phenylmethoxyphenyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-ethyl-6-methyl-3-(4-phenylmethoxyphenyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(4-benzoxyphenyl)-5-ethyl-6-methyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C22H20N2O2S2 MolecularWeight: 408.5364

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=S)N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=S)N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C

InChI

InChI=1S/C22H20N2O2S2/c1-3-18-14(2)28-20-19(18)21(25)24(22(27)23-20)16-9-11-17(12-10-16)26-13-15-7-5-4-6-8-15/h4-12H,3,13H2,1-2H3,(H,23,27)