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

Systemtic Name: 5-butyl-1-methyl-9-oxidanylidene-N3,N7-diphenyl-3,7-diazabicyclo[3.3.1]nonane-3,7-dicarbothioamide Openeye Name: 5-butyl-1-methyl-9-oxo-N3,N7-diphenyl-3,7-diazabicyclo[3.3.1]nonane-3,7-dicarbothioamide CAS Name: 5-butyl-1-methyl-9-oxo-N3,N7-diphenyl-3,7-diazabicyclo[3.3.1]nonane-3,7-dicarbothioamide IUPAC Name: 5-butyl-1-methyl-9-oxo-3-N,7-N-diphenyl-3,7-diazabicyclo[3.3.1]nonane-3,7-dicarbothioamide Traditional Name: 5-butyl-9-keto-1-methyl-N,N'-diphenyl-3,7-diazabicyclo[3.3.1]nonane-3,7-dicarbothioamide Formula: C26H32N4OS2 MolecularWeight: 480.68848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC12CN(CC(C1=O)(CN(C2)C(=S)NC3=CC=CC=C3)C)C(=S)NC4=CC=CC=C4

Isomeric SMILES

CCCCC12CN(CC(C1=O)(CN(C2)C(=S)NC3=CC=CC=C3)C)C(=S)NC4=CC=CC=C4

InChI

InChI=1S/C26H32N4OS2/c1-3-4-15-26-18-29(23(32)27-20-11-7-5-8-12-20)16-25(2,22(26)31)17-30(19-26)24(33)28-21-13-9-6-10-14-21/h5-14H,3-4,15-19H2,1-2H3,(H,27,32)(H,28,33)