N-(2-cyanoethyl)-N-phenyl-2-(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-phenyl-2-(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(2-cyanoethyl)-N-phenyl-2-(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(2-cyanoethyl)-N-phenyl-2-[(2,5,6-trimethyl-4-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(2-cyanoethyl)-N-phenyl-2-(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide Traditional Name: N-(2-cyanoethyl)-N-phenyl-2-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)thio]acetamide Formula: C20H20N4OS2 MolecularWeight: 396.529

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC(=N2)C)SCC(=O)N(CCC#N)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC(=N2)C)SCC(=O)N(CCC#N)C3=CC=CC=C3)C

InChI

InChI=1S/C20H20N4OS2/c1-13-14(2)27-20-18(13)19(22-15(3)23-20)26-12-17(25)24(11-7-10-21)16-8-5-4-6-9-16/h4-6,8-9H,7,11-12H2,1-3H3