2-[4-(1-adamantyl)piperazin-1-yl]-N-(2,1,3-benzothiadiazol-4-yl)ethanamide

Systemtic Name: 2-[4-(1-adamantyl)piperazin-1-yl]-N-(2,1,3-benzothiadiazol-4-yl)ethanamide Openeye Name: 2-[4-(1-adamantyl)piperazin-1-yl]-N-(2,1,3-benzothiadiazol-4-yl)acetamide CAS Name: 2-[4-(1-adamantyl)-1-piperazinyl]-N-(2,1,3-benzothiadiazol-4-yl)acetamide IUPAC Name: 2-[4-(1-adamantyl)piperazin-1-yl]-N-(2,1,3-benzothiadiazol-4-yl)acetamide Traditional Name: 2-[4-(1-adamantyl)piperazino]-N-piazthiol-4-yl-acetamide Formula: C22H29N5OS MolecularWeight: 411.56356

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=CC=CC3=NSN=C32)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=CC=CC3=NSN=C32)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C22H29N5OS/c28-20(23-18-2-1-3-19-21(18)25-29-24-19)14-26-4-6-27(7-5-26)22-11-15-8-16(12-22)10-17(9-15)13-22/h1-3,15-17H,4-14H2,(H,23,28)