N-(2,1,3-benzothiadiazol-5-yl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(2,1,3-benzothiadiazol-5-yl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(2,1,3-benzothiadiazol-5-yl)-2-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(2,1,3-benzothiadiazol-5-yl)-2-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(2,1,3-benzothiadiazol-5-yl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: 2-(4-p-cumenylsulfonylpiperazino)-N-piazthiol-5-yl-acetamide Formula: C21H25N5O3S2 MolecularWeight: 459.5849

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC4=NSN=C4C=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC4=NSN=C4C=C3

InChI

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