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

Systemtic Name: 5-[4-(3-methylphenyl)piperazin-1-yl]sulfonyl-6-oxidanylidene-1H-pyrimidin-2-olate Openeye Name: 5-[4-(m-tolyl)piperazin-1-yl]sulfonyl-6-oxo-1H-pyrimidin-2-olate CAS Name: 5-[[4-(3-methylphenyl)-1-piperazinyl]sulfonyl]-6-oxo-1H-pyrimidin-2-olate IUPAC Name: 5-[4-(3-methylphenyl)piperazin-1-yl]sulfonyl-6-oxo-1H-pyrimidin-2-olate Traditional Name: 6-keto-5-[4-(m-tolyl)piperazino]sulfonyl-1H-pyrimidin-2-olate Formula: C15H17N4O4S- MolecularWeight: 349.38488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=CN=C(NC3=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=CN=C(NC3=O)[O-]

InChI

InChI=1S/C15H18N4O4S/c1-11-3-2-4-12(9-11)18-5-7-19(8-6-18)24(22,23)13-10-16-15(21)17-14(13)20/h2-4,9-10H,5-8H2,1H3,(H2,16,17,20,21)/p-1