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

Systemtic Name: (2S)-N-cycloheptyl-2-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanamide Openeye Name: (2S)-N-cycloheptyl-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanamide CAS Name: (2S)-N-cycloheptyl-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]propanamide IUPAC Name: (2S)-N-cycloheptyl-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanamide Traditional Name: (2S)-N-cycloheptyl-2-[(4-keto-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]propionamide Formula: C23H27N3O2S2 MolecularWeight: 441.60938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCCC1)SCC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

C[C@@H](C(=O)NC1CCCCCC1)SCC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C23H27N3O2S2/c1-15(21(27)24-17-11-7-2-3-8-12-17)29-14-19-25-22(28)20-18(13-30-23(20)26-19)16-9-5-4-6-10-16/h4-6,9-10,13,15,17H,2-3,7-8,11-12,14H2,1H3,(H,24,27)(H,25,26,28)/t15-/m0/s1