1-(3-bicyclo[2.2.2]octanyl)-1-methyl-3-[(E)-1-pyridin-2-ylethylideneamino]thiourea

Systemtic Name: 1-(3-bicyclo[2.2.2]octanyl)-1-methyl-3-[(E)-1-pyridin-2-ylethylideneamino]thiourea Openeye Name: 1-(3-bicyclo[2.2.2]octanyl)-1-methyl-3-[(E)-1-(2-pyridyl)ethylideneamino]thiourea CAS Name: 1-(3-bicyclo[2.2.2]octanyl)-1-methyl-3-[(E)-1-(2-pyridinyl)ethylideneamino]thiourea IUPAC Name: 1-(3-bicyclo[2.2.2]octanyl)-1-methyl-3-[(E)-1-pyridin-2-ylethylideneamino]thiourea Traditional Name: 1-(3-bicyclo[2.2.2]octanyl)-1-methyl-3-[(E)-1-(2-pyridyl)ethylideneamino]thiourea Formula: C17H24N4S MolecularWeight: 316.46426

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)N(C)C1CC2CCC1CC2)C3=CC=CC=N3

Isomeric SMILES

C/C(=N\NC(=S)N(C)C1CC2CCC1CC2)/C3=CC=CC=N3

InChI

InChI=1S/C17H24N4S/c1-12(15-5-3-4-10-18-15)19-20-17(22)21(2)16-11-13-6-8-14(16)9-7-13/h3-5,10,13-14,16H,6-9,11H2,1-2H3,(H,20,22)/b19-12+