iron(4+); 4-(1-piperidin-1-id-2-ylethylideneamino)-1-[1-(2H-pyridin-1-id-6-yl)ethylideneamino]butan-2-ol; diisothiocyanate

Systemtic Name: iron(4+); 4-(1-piperidin-1-id-2-ylethylideneamino)-1-[1-(2H-pyridin-1-id-6-yl)ethylideneamino]butan-2-ol; diisothiocyanate Openeye Name: iron(4+); 4-(1-piperidin-1-id-2-ylethylideneamino)-1-[1-(2H-pyridin-1-id-6-yl)ethylideneamino]butan-2-ol; diisothiocyanate CAS Name: iron(4+); 4-[1-(2-piperidin-1-idyl)ethylideneamino]-1-[1-(2H-pyridin-1-id-6-yl)ethylideneamino]-2-butanol; diisothiocyanate IUPAC Name: iron(4+); 4-(1-piperidin-1-id-2-ylethylideneamino)-1-[1-(2H-pyridin-1-id-6-yl)ethylideneamino]butan-2-ol; diisothiocyanate Traditional Name: iron(4+); 4-(1-piperidin-1-id-2-ylethylideneamino)-1-[1-(2H-pyridin-1-id-6-yl)ethylideneamino]butan-2-ol; diisothiocyanate Formula: C20H28FeN6OS2 MolecularWeight: 488.45092

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NCCC(CN=C(C)C1=CC=CC[N-]1)O)C2CCCC[N-]2.C(=[N-])=S.C(=[N-])=S.[Fe+4]

Isomeric SMILES

CC(=NCCC(CN=C(C)C1=CC=CC[N-]1)O)C2CCCC[N-]2.C(=[N-])=S.C(=[N-])=S.[Fe+4]

InChI

InChI=1S/C18H28N4O.2CNS.Fe/c1-14(17-7-3-5-10-20-17)19-12-9-16(23)13-22-15(2)18-8-4-6-11-21-18;2*2-1-3;/h4,6,8,16-17,23H,3,5,7,9-13H2,1-2H3;;;/q-2;2*-1;+4