N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-9-oxidanylidene-bicyclo[3.3.1]nonane-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-9-oxidanylidene-bicyclo[3.3.1]nonane-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-9-oxo-bicyclo[3.3.1]nonane-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-9-oxo-3-bicyclo[3.3.1]nonanecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-9-oxobicyclo[3.3.1]nonane-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-9-keto-bicyclo[3.3.1]nonane-3-carboxamide Formula: C25H26N2O2S MolecularWeight: 418.55114

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)C4CC5CCCC(C4)C5=O

Isomeric SMILES

CCC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)C4CC5CCCC(C4)C5=O

InChI

InChI=1S/C25H26N2O2S/c1-2-16-10-12-20(13-11-16)27(25-26-21-8-3-4-9-22(21)30-25)24(29)19-14-17-6-5-7-18(15-19)23(17)28/h3-4,8-13,17-19H,2,5-7,14-15H2,1H3