N-[(E)-1-pyridazin-3-ylethylideneamino]-3-azabicyclo[3.2.2]nonane-3-carbothioamide

Systemtic Name: N-[(E)-1-pyridazin-3-ylethylideneamino]-3-azabicyclo[3.2.2]nonane-3-carbothioamide Openeye Name: N-[(E)-1-pyridazin-3-ylethylideneamino]-3-azabicyclo[3.2.2]nonane-3-carbothioamide CAS Name: N-[(E)-1-(3-pyridazinyl)ethylideneamino]-3-azabicyclo[3.2.2]nonane-3-carbothioamide IUPAC Name: N-[(E)-1-pyridazin-3-ylethylideneamino]-3-azabicyclo[3.2.2]nonane-3-carbothioamide Traditional Name: N-[(E)-1-pyridazin-3-ylethylideneamino]-3-azabicyclo[3.2.2]nonane-3-carbothioamide Formula: C15H21N5S MolecularWeight: 303.42574

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)N1CC2CCC(C1)CC2)C3=NN=CC=C3

Isomeric SMILES

C/C(=N\NC(=S)N1CC2CCC(C1)CC2)/C3=NN=CC=C3

InChI

InChI=1S/C15H21N5S/c1-11(14-3-2-8-16-18-14)17-19-15(21)20-9-12-4-5-13(10-20)7-6-12/h2-3,8,12-13H,4-7,9-10H2,1H3,(H,19,21)/b17-11+