N-[(2S)-2-cyano-3-methyl-butan-2-yl]-2-(4-oxidanylidene-6-phenyl-3-prop-2-enyl-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(2S)-2-cyano-3-methyl-butan-2-yl]-2-(4-oxidanylidene-6-phenyl-3-prop-2-enyl-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-6-phenyl-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-N-[(1S)-1-cyano-1,2-dimethyl-propyl]acetamide CAS Name: N-[(2S)-2-cyano-3-methylbutan-2-yl]-2-[(4-oxo-6-phenyl-3-prop-2-enyl-2-thieno[3,2-d]pyrimidinyl)thio]acetamide IUPAC Name: N-[(2S)-2-cyano-3-methylbutan-2-yl]-2-(4-oxo-6-phenyl-3-prop-2-enylthieno[3,2-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-4-keto-6-phenyl-thieno[3,2-d]pyrimidin-2-yl)thio]-N-[(1S)-1-cyano-1,2-dimethyl-propyl]acetamide Formula: C23H24N4O2S2 MolecularWeight: 452.59226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)CSC1=NC2=C(C(=O)N1CC=C)SC(=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@](C)(C#N)NC(=O)CSC1=NC2=C(C(=O)N1CC=C)SC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H24N4O2S2/c1-5-11-27-21(29)20-17(12-18(31-20)16-9-7-6-8-10-16)25-22(27)30-13-19(28)26-23(4,14-24)15(2)3/h5-10,12,15H,1,11,13H2,2-4H3,(H,26,28)/t23-/m1/s1