2-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[(4-besylpiperazino)methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C17H18N4O3S2 MolecularWeight: 390.47982

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=O)C3=C(N2)C=CS3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=NC(=O)C3=C(N2)C=CS3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C17H18N4O3S2/c22-17-16-14(6-11-25-16)18-15(19-17)12-20-7-9-21(10-8-20)26(23,24)13-4-2-1-3-5-13/h1-6,11H,7-10,12H2,(H,18,19,22)