N-(1-adamantylmethyl)-4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazine-1-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazine-1-carboxamide Openeye Name: N-(1-adamantylmethyl)-4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazine-1-carboxamide CAS Name: N-(1-adamantylmethyl)-4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinecarboxamide IUPAC Name: N-(1-adamantylmethyl)-4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazine-1-carboxamide Traditional Name: N-(1-adamantylmethyl)-4-piazthiol-4-ylsulfonyl-piperazine-1-carboxamide Formula: C22H29N5O3S2 MolecularWeight: 475.62736

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCC23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=CC6=NSN=C65

Isomeric SMILES

C1CN(CCN1C(=O)NCC23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=CC6=NSN=C65

InChI

InChI=1S/C22H29N5O3S2/c28-21(23-14-22-11-15-8-16(12-22)10-17(9-15)13-22)26-4-6-27(7-5-26)32(29,30)19-3-1-2-18-20(19)25-31-24-18/h1-3,15-17H,4-14H2,(H,23,28)