9-oxidanylidene-N3,N7-diphenyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonane-3,7-dicarbothioamide

Systemtic Name: 9-oxidanylidene-N3,N7-diphenyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonane-3,7-dicarbothioamide Openeye Name: 9-oxo-N3,N7-diphenyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonane-3,7-dicarbothioamide CAS Name: 9-oxo-N3,N7-diphenyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonane-3,7-dicarbothioamide IUPAC Name: 9-oxo-3-N,7-N-diphenyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonane-3,7-dicarbothioamide Traditional Name: 9-keto-N,N'-diphenyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonane-3,7-dicarbothioamide Formula: C27H34N4OS2 MolecularWeight: 494.71506

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Descriptors Computed from Structure

Canonical SMILES:

CCCC12CN(CC(C1=O)(CN(C2)C(=S)NC3=CC=CC=C3)CCC)C(=S)NC4=CC=CC=C4

Isomeric SMILES

CCCC12CN(CC(C1=O)(CN(C2)C(=S)NC3=CC=CC=C3)CCC)C(=S)NC4=CC=CC=C4

InChI

InChI=1S/C27H34N4OS2/c1-3-15-26-17-30(24(33)28-21-11-7-5-8-12-21)19-27(16-4-2,23(26)32)20-31(18-26)25(34)29-22-13-9-6-10-14-22/h5-14H,3-4,15-20H2,1-2H3,(H,28,33)(H,29,34)