chloranylcopper(1+); N,N-dicyclohexyl-N'-[(E)-1-pyridin-2-ylethylideneamino]carbamimidothioate

Systemtic Name: chloranylcopper(1+); N,N-dicyclohexyl-N'-[(E)-1-pyridin-2-ylethylideneamino]carbamimidothioate Openeye Name: chlorocopper(1+); N,N-dicyclohexyl-N'-[(E)-1-(2-pyridyl)ethylideneamino]carbamimidothioate CAS Name: chlorocopper(1+); N,N-dicyclohexyl-N'-[(E)-1-(2-pyridinyl)ethylideneamino]carbamimidothioate IUPAC Name: chlorocopper(1+); N,N-dicyclohexyl-N'-[(E)-1-pyridin-2-ylethylideneamino]carbamimidothioate Traditional Name: chlorocopper(1+); N,N-dicyclohexyl-N'-[(E)-1-(2-pyridyl)ethylideneamino]carbamimidothioate Formula: C20H29ClCuN4S MolecularWeight: 456.53506

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN=C(N(C1CCCCC1)C2CCCCC2)[S-])C3=CC=CC=N3.Cl[Cu+]

Isomeric SMILES

C/C(=N\N=C(\N(C1CCCCC1)C2CCCCC2)/[S-])/C3=CC=CC=N3.Cl[Cu+]

InChI

InChI=1S/C20H30N4S.ClH.Cu/c1-16(19-14-8-9-15-21-19)22-23-20(25)24(17-10-4-2-5-11-17)18-12-6-3-7-13-18;;/h8-9,14-15,17-18H,2-7,10-13H2,1H3,(H,23,25);1H;/q;;+2/p-2/b22-16+;;