5-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-6-oxidanylidene-1H-pyrimidin-2-olate

Systemtic Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-6-oxidanylidene-1H-pyrimidin-2-olate Openeye Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-6-oxo-1H-pyrimidin-2-olate CAS Name: 5-[[4-(3-chlorophenyl)-1-piperazinyl]sulfonyl]-6-oxo-1H-pyrimidin-2-olate IUPAC Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-6-oxo-1H-pyrimidin-2-olate Traditional Name: 5-[4-(3-chlorophenyl)piperazino]sulfonyl-6-keto-1H-pyrimidin-2-olate Formula: C14H14ClN4O4S- MolecularWeight: 369.80336

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)S(=O)(=O)C3=CN=C(NC3=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)S(=O)(=O)C3=CN=C(NC3=O)[O-]

InChI

InChI=1S/C14H15ClN4O4S/c15-10-2-1-3-11(8-10)18-4-6-19(7-5-18)24(22,23)12-9-16-14(21)17-13(12)20/h1-3,8-9H,4-7H2,(H2,16,17,20,21)/p-1