2-[[3-(4-fluorophenyl)sulfanylpropylamino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[[3-(4-fluorophenyl)sulfanylpropylamino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[[3-(4-fluorophenyl)sulfanylpropylamino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[3-[(4-fluorophenyl)thio]propylamino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[[3-(4-fluorophenyl)sulfanylpropylamino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[3-[(4-fluorophenyl)thio]propylamino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C16H16FN3OS2 MolecularWeight: 349.446143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1F)SCCCNCC2=NC(=O)C3=C(N2)C=CS3

Isomeric SMILES

C1=CC(=CC=C1F)SCCCNCC2=NC(=O)C3=C(N2)C=CS3

InChI

InChI=1S/C16H16FN3OS2/c17-11-2-4-12(5-3-11)22-8-1-7-18-10-14-19-13-6-9-23-15(13)16(21)20-14/h2-6,9,18H,1,7-8,10H2,(H,19,20,21)