2-(3-ethyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(3-methylbutyl)ethanamide

Systemtic Name: 2-(3-ethyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(3-methylbutyl)ethanamide Openeye Name: 2-(3-ethyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-isopentyl-acetamide CAS Name: 2-[(3-ethyl-4-oxo-5-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]-N-(3-methylbutyl)acetamide IUPAC Name: 2-(3-ethyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(3-methylbutyl)acetamide Traditional Name: 2-[(3-ethyl-4-keto-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]-N-isoamyl-acetamide Formula: C21H25N3O2S2 MolecularWeight: 415.5721

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SCC(=O)NCCC(C)C)SC=C2C3=CC=CC=C3

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SCC(=O)NCCC(C)C)SC=C2C3=CC=CC=C3

InChI

InChI=1S/C21H25N3O2S2/c1-4-24-20(26)18-16(15-8-6-5-7-9-15)12-27-19(18)23-21(24)28-13-17(25)22-11-10-14(2)3/h5-9,12,14H,4,10-11,13H2,1-3H3,(H,22,25)