9-oxidanylidene-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]bicyclo[3.3.1]nonane-3-carboxamide

Systemtic Name: 9-oxidanylidene-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]bicyclo[3.3.1]nonane-3-carboxamide Openeye Name: 9-oxo-N-[2-(3-thienylmethylsulfanyl)phenyl]bicyclo[3.3.1]nonane-3-carboxamide CAS Name: 9-oxo-N-[2-(3-thiophenylmethylthio)phenyl]-3-bicyclo[3.3.1]nonanecarboxamide IUPAC Name: 9-oxo-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]bicyclo[3.3.1]nonane-3-carboxamide Traditional Name: 9-keto-N-[2-(3-thenylthio)phenyl]bicyclo[3.3.1]nonane-3-carboxamide Formula: C21H23NO2S2 MolecularWeight: 385.54282

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC(C1)C2=O)C(=O)NC3=CC=CC=C3SCC4=CSC=C4

Isomeric SMILES

C1CC2CC(CC(C1)C2=O)C(=O)NC3=CC=CC=C3SCC4=CSC=C4

InChI

InChI=1S/C21H23NO2S2/c23-20-15-4-3-5-16(20)11-17(10-15)21(24)22-18-6-1-2-7-19(18)26-13-14-8-9-25-12-14/h1-2,6-9,12,15-17H,3-5,10-11,13H2,(H,22,24)