N-[(2S)-3-methylbutan-2-yl]-2-(3-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(2S)-3-methylbutan-2-yl]-2-(3-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(1S)-1,2-dimethylpropyl]-2-(3-methyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[(2S)-3-methylbutan-2-yl]-2-[(3-methyl-4-oxo-5-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-[(2S)-3-methylbutan-2-yl]-2-(3-methyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[(1S)-1,2-dimethylpropyl]-2-[(4-keto-3-methyl-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]acetamide Formula: C20H23N3O2S2 MolecularWeight: 401.54552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)CSC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1C

Isomeric SMILES

C[C@@H](C(C)C)NC(=O)CSC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1C

InChI

InChI=1S/C20H23N3O2S2/c1-12(2)13(3)21-16(24)11-27-20-22-18-17(19(25)23(20)4)15(10-26-18)14-8-6-5-7-9-14/h5-10,12-13H,11H2,1-4H3,(H,21,24)/t13-/m0/s1