2-[5-(3,4-dimethylphenyl)-3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-propyl-propanamide

Systemtic Name: 2-[5-(3,4-dimethylphenyl)-3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-propyl-propanamide Openeye Name: 2-[5-(3,4-dimethylphenyl)-3-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-propyl-propanamide CAS Name: 2-[[5-(3,4-dimethylphenyl)-3-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]-N-propylpropanamide IUPAC Name: 2-[5-(3,4-dimethylphenyl)-3-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-propylpropanamide Traditional Name: 2-[[5-(3,4-dimethylphenyl)-4-keto-3-methyl-thieno[2,3-d]pyrimidin-2-yl]thio]-N-propyl-propionamide Formula: C21H25N3O2S2 MolecularWeight: 415.5721

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)SC1=NC2=C(C(=CS2)C3=CC(=C(C=C3)C)C)C(=O)N1C

Isomeric SMILES

CCCNC(=O)C(C)SC1=NC2=C(C(=CS2)C3=CC(=C(C=C3)C)C)C(=O)N1C

InChI

InChI=1S/C21H25N3O2S2/c1-6-9-22-18(25)14(4)28-21-23-19-17(20(26)24(21)5)16(11-27-19)15-8-7-12(2)13(3)10-15/h7-8,10-11,14H,6,9H2,1-5H3,(H,22,25)