N-(2,1,3-benzothiadiazol-4-yl)-2-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(2,1,3-benzothiadiazol-4-yl)-2-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(2,1,3-benzothiadiazol-4-yl)-2-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(2,1,3-benzothiadiazol-4-yl)-2-[4-(4-propylphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(2,1,3-benzothiadiazol-4-yl)-2-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-piazthiol-4-yl-2-[4-(4-propylphenyl)sulfonylpiperazino]acetamide Formula: C21H25N5O3S2 MolecularWeight: 459.5849

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC4=NSN=C43

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC4=NSN=C43

InChI

InChI=1S/C21H25N5O3S2/c1-2-4-16-7-9-17(10-8-16)31(28,29)26-13-11-25(12-14-26)15-20(27)22-18-5-3-6-19-21(18)24-30-23-19/h3,5-10H,2,4,11-15H2,1H3,(H,22,27)