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

Systemtic Name: N-[(2S)-2-cyano-3-methyl-butan-2-yl]-2-(6-ethyl-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-allyl-6-ethyl-4-oxo-thieno[2,3-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-[(6-ethyl-4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-[(2S)-2-cyano-3-methylbutan-2-yl]-2-(6-ethyl-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-6-ethyl-4-keto-thieno[2,3-d]pyrimidin-2-yl)thio]-N-[(1S)-1-cyano-1,2-dimethyl-propyl]acetamide Formula: C19H24N4O2S2 MolecularWeight: 404.54946

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=C(N(C2=O)CC=C)SCC(=O)NC(C)(C#N)C(C)C

Isomeric SMILES

CCC1=CC2=C(S1)N=C(N(C2=O)CC=C)SCC(=O)N[C@](C)(C#N)C(C)C

InChI

InChI=1S/C19H24N4O2S2/c1-6-8-23-17(25)14-9-13(7-2)27-16(14)21-18(23)26-10-15(24)22-19(5,11-20)12(3)4/h6,9,12H,1,7-8,10H2,2-5H3,(H,22,24)/t19-/m1/s1