N-[(E)-1-pyridazin-3-ylethylideneamino]-3-azabicyclo[3.2.1]octane-3-carbothioamide

Systemtic Name: N-[(E)-1-pyridazin-3-ylethylideneamino]-3-azabicyclo[3.2.1]octane-3-carbothioamide Openeye Name: N-[(E)-1-pyridazin-3-ylethylideneamino]-3-azabicyclo[3.2.1]octane-3-carbothioamide CAS Name: N-[(E)-1-(3-pyridazinyl)ethylideneamino]-3-azabicyclo[3.2.1]octane-3-carbothioamide IUPAC Name: N-[(E)-1-pyridazin-3-ylethylideneamino]-3-azabicyclo[3.2.1]octane-3-carbothioamide Traditional Name: N-[(E)-1-pyridazin-3-ylethylideneamino]-3-azabicyclo[3.2.1]octane-3-carbothioamide Formula: C14H19N5S MolecularWeight: 289.39916

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)N1CC2CCC(C2)C1)C3=NN=CC=C3

Isomeric SMILES

C/C(=N\NC(=S)N1CC2CCC(C2)C1)/C3=NN=CC=C3

InChI

InChI=1S/C14H19N5S/c1-10(13-3-2-6-15-17-13)16-18-14(20)19-8-11-4-5-12(7-11)9-19/h2-3,6,11-12H,4-5,7-9H2,1H3,(H,18,20)/b16-10+