3,6-dihydro-2H-pyridin-1-ide; nickel; oxidanyl(pyrrol-1-yl)methanethiolate; piperidin-1-ide

Systemtic Name: 3,6-dihydro-2H-pyridin-1-ide; nickel; oxidanyl(pyrrol-1-yl)methanethiolate; piperidin-1-ide Openeye Name: 3,6-dihydro-2H-pyridin-1-ide; hydroxy(pyrrol-1-yl)methanethiolate; nickel; piperidin-1-ide CAS Name: 3,6-dihydro-2H-pyridin-1-ide; hydroxy(1-pyrrolyl)methanethiolate; nickel; piperidin-1-ide IUPAC Name: 3,6-dihydro-2H-pyridin-1-ide; hydroxy(pyrrol-1-yl)methanethiolate; nickel; piperidin-1-ide Traditional Name: 3,6-dihydro-2H-pyridin-1-ide; hydroxy(pyrrol-1-yl)methanethiolate; nickel; piperidin-1-ide Formula: C20H30N4NiO2S2-4 MolecularWeight: 481.3012

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N-]CC1.C1C[N-]CC=C1.C1=CN(C=C1)C(O)[S-].C1=CN(C=C1)C(O)[S-].[Ni]

Isomeric SMILES

C1CC[N-]CC1.C1C[N-]CC=C1.C1=CN(C=C1)C(O)[S-].C1=CN(C=C1)C(O)[S-].[Ni]

InChI

InChI=1S/2C5H7NOS.C5H10N.C5H8N.Ni/c2*7-5(8)6-3-1-2-4-6;2*1-2-4-6-5-3-1;/h2*1-5,7-8H;1-5H2;1-2H,3-5H2;/q;;2*-1;/p-2