dicopper 2-[C-methyl-N-[piperidin-1-yl(sulfaniumylidene)methyl]azanidyl-carbonimidoyl]phenolate

Systemtic Name: dicopper 2-[C-methyl-N-[piperidin-1-yl(sulfaniumylidene)methyl]azanidyl-carbonimidoyl]phenolate Openeye Name: dicopper 2-[C-methyl-N-[1-piperidyl(sulfoniumylidene)methyl]azanidyl-carbonimidoyl]phenolate CAS Name: dicopper 2-[1-[1-piperidinyl(sulfoniumylidene)methyl]azanidyliminoethyl]phenolate IUPAC Name: dicopper 2-[C-methyl-N-[piperidin-1-yl(sulfoniumylidene)methyl]azanidylcarbonimidoyl]phenolate Traditional Name: dicupric 2-[C-methyl-N-[piperidino(sulfoniumylidene)methyl]azanidyl-carbonimidoyl]phenolate Formula: C28H36Cu2N6O2S2+2 MolecularWeight: 679.84644

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N[N-]C(=[SH+])N1CCCCC1)C2=CC=CC=C2[O-].CC(=N[N-]C(=[SH+])N1CCCCC1)C2=CC=CC=C2[O-].[Cu+2].[Cu+2]

Isomeric SMILES

CC(=N[N-]C(=[SH+])N1CCCCC1)C2=CC=CC=C2[O-].CC(=N[N-]C(=[SH+])N1CCCCC1)C2=CC=CC=C2[O-].[Cu+2].[Cu+2]

InChI

InChI=1S/2C14H19N3OS.2Cu/c2*1-11(12-7-3-4-8-13(12)18)15-16-14(19)17-9-5-2-6-10-17;;/h2*3-4,7-8H,2,5-6,9-10H2,1H3,(H2,15,16,18,19);;/q;;2*+2/p-2