2-(2-chlorophenyl)-7-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

Systemtic Name: 2-(2-chlorophenyl)-7-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Openeye Name: 7-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-2-(2-chlorophenyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one CAS Name: 7-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-2-(2-chlorophenyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one IUPAC Name: 7-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-2-(2-chlorophenyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Traditional Name: 7-[(4-besylpiperazino)methyl]-2-(2-chlorophenyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Formula: C22H20ClN5O3S2 MolecularWeight: 502.0089

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=O)N3C(=N2)SC(=N3)C4=CC=CC=C4Cl)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC(=O)N3C(=N2)SC(=N3)C4=CC=CC=C4Cl)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C22H20ClN5O3S2/c23-19-9-5-4-8-18(19)21-25-28-20(29)14-16(24-22(28)32-21)15-26-10-12-27(13-11-26)33(30,31)17-6-2-1-3-7-17/h1-9,14H,10-13,15H2