(2S)-N-(4-ethanoylphenyl)-2-(4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N-(4-ethanoylphenyl)-2-(4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-propanamide Openeye Name: (2S)-N-(4-acetylphenyl)-2-(4-oxo-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-propanamide CAS Name: (2S)-N-(4-acetylphenyl)-2-[(4-oxo-3-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]propanamide IUPAC Name: (2S)-N-(4-acetylphenyl)-2-(4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylpropanamide Traditional Name: (2S)-N-(4-acetylphenyl)-2-[(4-keto-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]propionamide Formula: C23H19N3O3S2 MolecularWeight: 449.54526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)C)SC2=NC3=C(C=CS3)C(=O)N2C4=CC=CC=C4

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)C(=O)C)SC2=NC3=C(C=CS3)C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C23H19N3O3S2/c1-14(27)16-8-10-17(11-9-16)24-20(28)15(2)31-23-25-21-19(12-13-30-21)22(29)26(23)18-6-4-3-5-7-18/h3-13,15H,1-2H3,(H,24,28)/t15-/m0/s1