2-[3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-ethyl-ethanamide

Systemtic Name: 2-[3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-ethyl-ethanamide Openeye Name: 2-[3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-ethyl-acetamide CAS Name: 2-[[3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]-N-ethylacetamide IUPAC Name: 2-[3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-ethylacetamide Traditional Name: 2-[[3-(3,4-dimethylphenyl)-5-ethyl-4-keto-6-methyl-thieno[2,3-d]pyrimidin-2-yl]thio]-N-ethyl-acetamide Formula: C21H25N3O2S2 MolecularWeight: 415.5721

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)NCC)C3=CC(=C(C=C3)C)C)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)NCC)C3=CC(=C(C=C3)C)C)C

InChI

InChI=1S/C21H25N3O2S2/c1-6-16-14(5)28-19-18(16)20(26)24(15-9-8-12(3)13(4)10-15)21(23-19)27-11-17(25)22-7-2/h8-10H,6-7,11H2,1-5H3,(H,22,25)