4-[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidin-4-yl]carbonyl-1-phenethyl-piperazine-2,6-dione

Systemtic Name: 4-[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidin-4-yl]carbonyl-1-phenethyl-piperazine-2,6-dione Openeye Name: 4-[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidine-4-carbonyl]-1-phenethyl-piperazine-2,6-dione CAS Name: 4-[[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-4-piperidinyl]-oxomethyl]-1-phenethylpiperazine-2,6-dione IUPAC Name: 4-[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidine-4-carbonyl]-1-phenethylpiperazine-2,6-dione Traditional Name: 1-phenethyl-4-(1-piazthiol-4-ylsulfonylisonipecotoyl)piperazine-2,6-quinone Formula: C24H25N5O5S2 MolecularWeight: 527.6158

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CC(=O)N(C(=O)C2)CCC3=CC=CC=C3)S(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

C1CN(CCC1C(=O)N2CC(=O)N(C(=O)C2)CCC3=CC=CC=C3)S(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C24H25N5O5S2/c30-21-15-27(16-22(31)29(21)14-9-17-5-2-1-3-6-17)24(32)18-10-12-28(13-11-18)36(33,34)20-8-4-7-19-23(20)26-35-25-19/h1-8,18H,9-16H2