hex-5-en-2-yl-(4-methylphenyl)sulfonyl-azanide; palladium(2+); 1,10-phenanthroline

Systemtic Name: hex-5-en-2-yl-(4-methylphenyl)sulfonyl-azanide; palladium(2+); 1,10-phenanthroline Openeye Name: 1-methanidylpent-4-enyl(p-tolylsulfonyl)azanide; palladium(2+); 1,10-phenanthroline CAS Name: hex-5-en-2-yl-(4-methylphenyl)sulfonylazanide; palladium(2+); 1,10-phenanthroline IUPAC Name: hex-5-en-2-yl-(4-methylphenyl)sulfonylazanide; palladium(2+); 1,10-phenanthroline Traditional Name: 1-methanidylpent-4-enyl(tosyl)azanide; palladium(2+); 1,10-phenanthroline Formula: C25H25N3O2PdS MolecularWeight: 537.9699

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[N-]C([CH2-])CCC=C.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.[Pd+2]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[N-]C([CH2-])CCC=C.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.[Pd+2]

InChI

InChI=1S/C13H17NO2S.C12H8N2.Pd/c1-4-5-6-12(3)14-17(15,16)13-9-7-11(2)8-10-13;1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;/h4,7-10,12H,1,3,5-6H2,2H3;1-8H;/q-2;;+2