1-[(E)-1-azoniabicyclo[2.2.2]octan-3-ylideneamino]thiourea

Systemtic Name: 1-[(E)-1-azoniabicyclo[2.2.2]octan-3-ylideneamino]thiourea Openeye Name: [(E)-quinuclidin-1-ium-3-ylideneamino]thiourea CAS Name: [(E)-1-azoniabicyclo[2.2.2]octan-3-ylideneamino]thiourea IUPAC Name: [(E)-1-azoniabicyclo[2.2.2]octan-3-ylideneamino]thiourea Traditional Name: [(E)-quinuclidin-1-ium-3-ylideneamino]thiourea Formula: C8H15N4S+ MolecularWeight: 199.2965

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(=NNC(=S)N)C2

Isomeric SMILES

C1C[NH+]2CCC1/C(=N\NC(=S)N)/C2

InChI

InChI=1S/C8H14N4S/c9-8(13)11-10-7-5-12-3-1-6(7)2-4-12/h6H,1-5H2,(H3,9,11,13)/p+1/b10-7-