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

Systemtic Name: 3-[3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanylpropanamide Openeye Name: 3-[3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanylpropanamide CAS Name: 3-[[3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]propanamide IUPAC Name: 3-[3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanylpropanamide Traditional Name: 3-[[3-(3,4-dimethylphenyl)-5-ethyl-4-keto-6-methyl-thieno[2,3-d]pyrimidin-2-yl]thio]propionamide Formula: C20H23N3O2S2 MolecularWeight: 401.54552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O2S2/c1-5-15-13(4)27-18-17(15)19(25)23(14-7-6-11(2)12(3)10-14)20(22-18)26-9-8-16(21)24/h6-7,10H,5,8-9H2,1-4H3,(H2,21,24)