chloranylcopper(1+); (NE,1Z)-N-(1-pyrazin-2-ylethylidene)azepane-1-carbohydrazonothioate

Systemtic Name: chloranylcopper(1+); (NE,1Z)-N-(1-pyrazin-2-ylethylidene)azepane-1-carbohydrazonothioate Openeye Name: chlorocopper(1+); (NE,1Z)-N-(1-pyrazin-2-ylethylidene)azepane-1-carbohydrazonothioate CAS Name: chlorocopper(1+); (NE,1Z)-N-[1-(2-pyrazinyl)ethylidene]-1-azepanecarbohydrazonothioate IUPAC Name: chlorocopper(1+); (NE,1Z)-N-(1-pyrazin-2-ylethylidene)azepane-1-carbohydrazonothioate Traditional Name: chlorocopper(1+); (NE,1Z)-N-(1-pyrazin-2-ylethylidene)azepane-1-carbohydrazonothioate Formula: C13H18ClCuN5S MolecularWeight: 375.37952

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN=C(N1CCCCCC1)[S-])C2=NC=CN=C2.Cl[Cu+]

Isomeric SMILES

C/C(=N\N=C(\N1CCCCCC1)/[S-])/C2=NC=CN=C2.Cl[Cu+]

InChI

InChI=1S/C13H19N5S.ClH.Cu/c1-11(12-10-14-6-7-15-12)16-17-13(19)18-8-4-2-3-5-9-18;;/h6-7,10H,2-5,8-9H2,1H3,(H,17,19);1H;/q;;+2/p-2/b16-11+;;