5-[(4-ethoxyphenyl)methyl]-2-[(4-methylphenyl)sulfonylamino]-6-oxidanylidene-1H-pyrimidin-4-olate

Systemtic Name: 5-[(4-ethoxyphenyl)methyl]-2-[(4-methylphenyl)sulfonylamino]-6-oxidanylidene-1H-pyrimidin-4-olate Openeye Name: 5-[(4-ethoxyphenyl)methyl]-6-oxo-2-(p-tolylsulfonylamino)-1H-pyrimidin-4-olate CAS Name: 5-[(4-ethoxyphenyl)methyl]-2-[(4-methylphenyl)sulfonylamino]-6-oxo-1H-pyrimidin-4-olate IUPAC Name: 5-[(4-ethoxyphenyl)methyl]-2-[(4-methylphenyl)sulfonylamino]-6-oxo-1H-pyrimidin-4-olate Traditional Name: 5-(4-ethoxybenzyl)-6-keto-2-(tosylamino)-1H-pyrimidin-4-olate Formula: C20H20N3O5S- MolecularWeight: 414.4549

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC2=C(N=C(NC2=O)NS(=O)(=O)C3=CC=C(C=C3)C)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)CC2=C(N=C(NC2=O)NS(=O)(=O)C3=CC=C(C=C3)C)[O-]

InChI

InChI=1S/C20H21N3O5S/c1-3-28-15-8-6-14(7-9-15)12-17-18(24)21-20(22-19(17)25)23-29(26,27)16-10-4-13(2)5-11-16/h4-11H,3,12H2,1-2H3,(H3,21,22,23,24,25)/p-1