N-(1-azabicyclo[2.2.2]octan-3-ylcarbamothioyl)-5-bromanyl-naphthalene-1-carboxamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-ylcarbamothioyl)-5-bromanyl-naphthalene-1-carboxamide Openeye Name: 5-bromo-N-(quinuclidin-3-ylcarbamothioyl)naphthalene-1-carboxamide CAS Name: N-[(1-azabicyclo[2.2.2]octan-3-ylamino)-sulfanylidenemethyl]-5-bromo-1-naphthalenecarboxamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-ylcarbamothioyl)-5-bromonaphthalene-1-carboxamide Traditional Name: 5-bromo-N-(quinuclidin-3-ylthiocarbamoyl)-1-naphthamide Formula: C19H20BrN3OS MolecularWeight: 418.3506

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC(=S)NC(=O)C3=CC=CC4=C3C=CC=C4Br

Isomeric SMILES

C1CN2CCC1C(C2)NC(=S)NC(=O)C3=CC=CC4=C3C=CC=C4Br

InChI

InChI=1S/C19H20BrN3OS/c20-16-6-2-3-13-14(16)4-1-5-15(13)18(24)22-19(25)21-17-11-23-9-7-12(17)8-10-23/h1-6,12,17H,7-11H2,(H2,21,22,24,25)