N-(1-adamantyl)-4-(1,3-benzothiazol-2-yl)butanamide

Systemtic Name: N-(1-adamantyl)-4-(1,3-benzothiazol-2-yl)butanamide Openeye Name: N-(1-adamantyl)-4-(1,3-benzothiazol-2-yl)butanamide CAS Name: N-(1-adamantyl)-4-(1,3-benzothiazol-2-yl)butanamide IUPAC Name: N-(1-adamantyl)-4-(1,3-benzothiazol-2-yl)butanamide Traditional Name: N-(1-adamantyl)-4-(1,3-benzothiazol-2-yl)butyramide Formula: C21H26N2OS MolecularWeight: 354.50894

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)CCCC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)CCCC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H26N2OS/c24-19(6-3-7-20-22-17-4-1-2-5-18(17)25-20)23-21-11-14-8-15(12-21)10-16(9-14)13-21/h1-2,4-5,14-16H,3,6-13H2,(H,23,24)