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

Systemtic Name: 7-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]-2-(2-fluorophenyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Openeye Name: 7-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]-2-(2-fluorophenyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one CAS Name: 7-[[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]methyl]-2-(2-fluorophenyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one IUPAC Name: 7-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]-2-(2-fluorophenyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Traditional Name: 7-[[4-(4-chlorophenyl)sulfonylpiperazino]methyl]-2-(2-fluorophenyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Formula: C22H19ClFN5O3S2 MolecularWeight: 519.999363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=O)N3C(=N2)SC(=N3)C4=CC=CC=C4F)S(=O)(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC(=O)N3C(=N2)SC(=N3)C4=CC=CC=C4F)S(=O)(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C22H19ClFN5O3S2/c23-15-5-7-17(8-6-15)34(31,32)28-11-9-27(10-12-28)14-16-13-20(30)29-22(25-16)33-21(26-29)18-3-1-2-4-19(18)24/h1-8,13H,9-12,14H2