1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-4-(4-ethylphenyl)butane-1,4-dione

Systemtic Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-4-(4-ethylphenyl)butane-1,4-dione Openeye Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-4-(4-ethylphenyl)butane-1,4-dione CAS Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]-4-(4-ethylphenyl)butane-1,4-dione IUPAC Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-4-(4-ethylphenyl)butane-1,4-dione Traditional Name: 1-(4-ethylphenyl)-4-(4-piazthiol-4-ylsulfonylpiperazino)butane-1,4-dione Formula: C22H24N4O4S2 MolecularWeight: 472.58036

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C22H24N4O4S2/c1-2-16-6-8-17(9-7-16)19(27)10-11-21(28)25-12-14-26(15-13-25)32(29,30)20-5-3-4-18-22(20)24-31-23-18/h3-9H,2,10-15H2,1H3