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

Systemtic Name: N-[4-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]phenyl]ethanamide Openeye Name: N-[4-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]phenyl]acetamide CAS Name: N-[4-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]phenyl]acetamide IUPAC Name: N-[4-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]phenyl]acetamide Traditional Name: N-[4-[(4-keto-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]phenyl]acetamide Formula: C21H17N3O2S2 MolecularWeight: 407.50858

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C21H17N3O2S2/c1-13(25)22-15-7-9-16(10-8-15)27-12-18-23-20(26)19-17(11-28-21(19)24-18)14-5-3-2-4-6-14/h2-11H,12H2,1H3,(H,22,25)(H,23,24,26)