sodium (1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-(4-methylphenyl)sulfonyl-azanide

Systemtic Name: sodium (1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-(4-methylphenyl)sulfonyl-azanide Openeye Name: sodium (1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-(p-tolylsulfonyl)azanide CAS Name: sodium (1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-(4-methylphenyl)sulfonylazanide IUPAC Name: sodium (1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-(4-methylphenyl)sulfonylazanide Traditional Name: sodium (3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-tosyl-azanide Formula: C18H18N3NaO3S MolecularWeight: 379.40859

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[N-]C2=C(N(N(C2=O)C3=CC=CC=C3)C)C.[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[N-]C2=C(N(N(C2=O)C3=CC=CC=C3)C)C.[Na+]

InChI

InChI=1S/C18H18N3O3S.Na/c1-13-9-11-16(12-10-13)25(23,24)19-17-14(2)20(3)21(18(17)22)15-7-5-4-6-8-15;/h4-12H,1-3H3;/q-1;+1