2-(5-cyclopropyl-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-[(2S)-2-phenylpropyl]ethanamide

Systemtic Name: 2-(5-cyclopropyl-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-[(2S)-2-phenylpropyl]ethanamide Openeye Name: 2-(3-allyl-5-cyclopropyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-[(2S)-2-phenylpropyl]acetamide CAS Name: 2-[(5-cyclopropyl-4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]-N-[(2S)-2-phenylpropyl]acetamide IUPAC Name: 2-(5-cyclopropyl-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-[(2S)-2-phenylpropyl]acetamide Traditional Name: 2-[(3-allyl-5-cyclopropyl-4-keto-thieno[2,3-d]pyrimidin-2-yl)thio]-N-[(2S)-2-phenylpropyl]acetamide Formula: C23H25N3O2S2 MolecularWeight: 439.5935

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)CSC1=NC2=C(C(=CS2)C3CC3)C(=O)N1CC=C)C4=CC=CC=C4

Isomeric SMILES

C[C@H](CNC(=O)CSC1=NC2=C(C(=CS2)C3CC3)C(=O)N1CC=C)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3O2S2/c1-3-11-26-22(28)20-18(17-9-10-17)13-29-21(20)25-23(26)30-14-19(27)24-12-15(2)16-7-5-4-6-8-16/h3-8,13,15,17H,1,9-12,14H2,2H3,(H,24,27)/t15-/m1/s1