1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-4-(2-ethoxyphenoxy)butan-1-one

Systemtic Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-4-(2-ethoxyphenoxy)butan-1-one Openeye Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-4-(2-ethoxyphenoxy)butan-1-one CAS Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]-4-(2-ethoxyphenoxy)-1-butanone IUPAC Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-4-(2-ethoxyphenoxy)butan-1-one Traditional Name: 4-(2-ethoxyphenoxy)-1-(4-piazthiol-4-ylsulfonylpiperazino)butan-1-one Formula: C22H26N4O5S2 MolecularWeight: 490.59564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OCCCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CCOC1=CC=CC=C1OCCCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C22H26N4O5S2/c1-2-30-18-8-3-4-9-19(18)31-16-6-11-21(27)25-12-14-26(15-13-25)33(28,29)20-10-5-7-17-22(20)24-32-23-17/h3-5,7-10H,2,6,11-16H2,1H3