iron(2+); N'-methyl-N-[(E)-1-pyridin-2-ylethylideneamino]carbamimidothioate

Systemtic Name: iron(2+); N'-methyl-N-[(E)-1-pyridin-2-ylethylideneamino]carbamimidothioate Openeye Name: ferrous N'-methyl-N-[(E)-1-(2-pyridyl)ethylideneamino]carbamimidothioate CAS Name: iron(2+); N'-methyl-N-[(E)-1-(2-pyridinyl)ethylideneamino]carbamimidothioate IUPAC Name: iron(2+); N'-methyl-N-[(E)-1-pyridin-2-ylethylideneamino]carbamimidothioate Traditional Name: ferrous N'-methyl-N-[(E)-1-(2-pyridyl)ethylideneamino]carbamimidothioate Formula: C18H22FeN8S2 MolecularWeight: 470.39588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=NC)[S-])C1=CC=CC=N1.CC(=NNC(=NC)[S-])C1=CC=CC=N1.[Fe+2]

Isomeric SMILES

C/C(=N\NC(=NC)[S-])/C1=CC=CC=N1.C/C(=N\NC(=NC)[S-])/C1=CC=CC=N1.[Fe+2]

InChI

InChI=1S/2C9H12N4S.Fe/c2*1-7(12-13-9(14)10-2)8-5-3-4-6-11-8;/h2*3-6H,1-2H3,(H2,10,13,14);/q;;+2/p-2/b2*12-7+;