1-adamantyl-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: 1-adamantyl-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]methanone Openeye Name: 1-adamantyl-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]methanone CAS Name: 1-adamantyl-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]methanone IUPAC Name: 1-adamantyl-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]methanone Traditional Name: 1-adamantyl-(4-piazthiol-4-ylsulfonylpiperazino)methanone Formula: C21H26N4O3S2 MolecularWeight: 446.58614

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=CC6=NSN=C65

Isomeric SMILES

C1CN(CCN1C(=O)C23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=CC6=NSN=C65

InChI

InChI=1S/C21H26N4O3S2/c26-20(21-11-14-8-15(12-21)10-16(9-14)13-21)24-4-6-25(7-5-24)30(27,28)18-3-1-2-17-19(18)23-29-22-17/h1-3,14-16H,4-13H2