(2S)-N-cyclopropyl-2-(6-ethyl-4-oxidanylidene-3-phenethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenyl-ethanamide

Systemtic Name: (2S)-N-cyclopropyl-2-(6-ethyl-4-oxidanylidene-3-phenethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenyl-ethanamide Openeye Name: (2S)-N-cyclopropyl-2-(6-ethyl-4-oxo-3-phenethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenyl-acetamide CAS Name: (2S)-N-cyclopropyl-2-[(6-ethyl-4-oxo-3-phenethyl-2-thieno[2,3-d]pyrimidinyl)thio]-2-phenylacetamide IUPAC Name: (2S)-N-cyclopropyl-2-(6-ethyl-4-oxo-3-phenethylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenylacetamide Traditional Name: (2S)-N-cyclopropyl-2-[(6-ethyl-4-keto-3-phenethyl-thieno[2,3-d]pyrimidin-2-yl)thio]-2-phenyl-acetamide Formula: C27H27N3O2S2 MolecularWeight: 489.65218

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=C(N(C2=O)CCC3=CC=CC=C3)SC(C4=CC=CC=C4)C(=O)NC5CC5

Isomeric SMILES

CCC1=CC2=C(S1)N=C(N(C2=O)CCC3=CC=CC=C3)S[C@@H](C4=CC=CC=C4)C(=O)NC5CC5

InChI

InChI=1S/C27H27N3O2S2/c1-2-21-17-22-25(33-21)29-27(30(26(22)32)16-15-18-9-5-3-6-10-18)34-23(19-11-7-4-8-12-19)24(31)28-20-13-14-20/h3-12,17,20,23H,2,13-16H2,1H3,(H,28,31)/t23-/m0/s1