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

Systemtic Name: 4-[2-(2,1,3-benzothiadiazol-4-ylsulfonyl)ethanoyl]-1-phenethyl-piperazine-2,6-dione Openeye Name: 4-[2-(2,1,3-benzothiadiazol-4-ylsulfonyl)acetyl]-1-phenethyl-piperazine-2,6-dione CAS Name: 4-[2-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-oxoethyl]-1-phenethylpiperazine-2,6-dione IUPAC Name: 4-[2-(2,1,3-benzothiadiazol-4-ylsulfonyl)acetyl]-1-phenethylpiperazine-2,6-dione Traditional Name: 1-phenethyl-4-(2-piazthiol-4-ylsulfonylacetyl)piperazine-2,6-quinone Formula: C20H18N4O5S2 MolecularWeight: 458.51072

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C(=O)CN1C(=O)CS(=O)(=O)C2=CC=CC3=NSN=C32)CCC4=CC=CC=C4

Isomeric SMILES

C1C(=O)N(C(=O)CN1C(=O)CS(=O)(=O)C2=CC=CC3=NSN=C32)CCC4=CC=CC=C4

InChI

InChI=1S/C20H18N4O5S2/c25-17-11-23(12-18(26)24(17)10-9-14-5-2-1-3-6-14)19(27)13-31(28,29)16-8-4-7-15-20(16)22-30-21-15/h1-8H,9-13H2