5-cyclopropyl-2-(2-oxidanylidenepropylsulfanyl)-3-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-cyclopropyl-2-(2-oxidanylidenepropylsulfanyl)-3-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-acetonylsulfanyl-5-cyclopropyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-cyclopropyl-2-(2-oxopropylthio)-3-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-cyclopropyl-2-(2-oxopropylsulfanyl)-3-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(acetonylthio)-5-cyclopropyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C18H16N2O2S2 MolecularWeight: 356.46184

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NC2=C(C(=CS2)C3CC3)C(=O)N1C4=CC=CC=C4

Isomeric SMILES

CC(=O)CSC1=NC2=C(C(=CS2)C3CC3)C(=O)N1C4=CC=CC=C4

InChI

InChI=1S/C18H16N2O2S2/c1-11(21)9-24-18-19-16-15(14(10-23-16)12-7-8-12)17(22)20(18)13-5-3-2-4-6-13/h2-6,10,12H,7-9H2,1H3