N-(2-adamantyl)-5-(1,3-benzothiazol-2-yl)pentanamide

Systemtic Name: N-(2-adamantyl)-5-(1,3-benzothiazol-2-yl)pentanamide Openeye Name: N-(2-adamantyl)-5-(1,3-benzothiazol-2-yl)pentanamide CAS Name: N-(2-adamantyl)-5-(1,3-benzothiazol-2-yl)pentanamide IUPAC Name: N-(2-adamantyl)-5-(1,3-benzothiazol-2-yl)pentanamide Traditional Name: N-(2-adamantyl)-5-(1,3-benzothiazol-2-yl)valeramide Formula: C22H28N2OS MolecularWeight: 368.53552

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=O)CCCCC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)CCCCC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H28N2OS/c25-20(24-22-16-10-14-9-15(12-16)13-17(22)11-14)7-3-4-8-21-23-18-5-1-2-6-19(18)26-21/h1-2,5-6,14-17,22H,3-4,7-13H2,(H,24,25)