(2S)-2-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-phenethyl-propanamide

Systemtic Name: (2S)-2-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-phenethyl-propanamide Openeye Name: (2S)-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-phenethyl-propanamide CAS Name: (2S)-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]-N-phenethylpropanamide IUPAC Name: (2S)-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-phenethylpropanamide Traditional Name: (2S)-2-[(4-keto-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]-N-phenethyl-propionamide Formula: C24H23N3O2S2 MolecularWeight: 449.58832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=CC=C1)SCC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

C[C@@H](C(=O)NCCC1=CC=CC=C1)SCC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C24H23N3O2S2/c1-16(22(28)25-13-12-17-8-4-2-5-9-17)30-15-20-26-23(29)21-19(14-31-24(21)27-20)18-10-6-3-7-11-18/h2-11,14,16H,12-13,15H2,1H3,(H,25,28)(H,26,27,29)/t16-/m0/s1