5-(4-fluorophenyl)-2-[(4-thiophen-2-ylcarbonylpiperazin-1-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-fluorophenyl)-2-[(4-thiophen-2-ylcarbonylpiperazin-1-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-fluorophenyl)-2-[[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-fluorophenyl)-2-[[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(4-fluorophenyl)-2-[[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-fluorophenyl)-2-[[4-(2-thenoyl)piperazino]methyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C22H19FN4O2S2 MolecularWeight: 454.540263

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=C(C(=CS3)C4=CC=C(C=C4)F)C(=O)N2)C(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1CC2=NC3=C(C(=CS3)C4=CC=C(C=C4)F)C(=O)N2)C(=O)C5=CC=CS5

InChI

InChI=1S/C22H19FN4O2S2/c23-15-5-3-14(4-6-15)16-13-31-21-19(16)20(28)24-18(25-21)12-26-7-9-27(10-8-26)22(29)17-2-1-11-30-17/h1-6,11,13H,7-10,12H2,(H,24,25,28)