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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4CC5CCCC(C4)C5=O

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4CC5CCCC(C4)C5=O

InChI

InChI=1S/C25H26N2O2S/c1-16-7-5-12-21-22(16)26-25(30-21)27(15-17-8-3-2-4-9-17)24(29)20-13-18-10-6-11-19(14-20)23(18)28/h2-5,7-9,12,18-20H,6,10-11,13-15H2,1H3