2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-N-(3-chlorophenyl)ethanamide

Systemtic Name: 2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-N-(3-chlorophenyl)ethanamide Openeye Name: N-(3-chlorophenyl)-2-[4-(4-sec-butylphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: 2-[4-(4-butan-2-ylphenyl)sulfonyl-1-piperazinyl]-N-(3-chlorophenyl)acetamide IUPAC Name: 2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-N-(3-chlorophenyl)acetamide Traditional Name: N-(3-chlorophenyl)-2-[4-(4-sec-butylphenyl)sulfonylpiperazino]acetamide Formula: C22H28ClN3O3S MolecularWeight: 449.99402

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H28ClN3O3S/c1-3-17(2)18-7-9-21(10-8-18)30(28,29)26-13-11-25(12-14-26)16-22(27)24-20-6-4-5-19(23)15-20/h4-10,15,17H,3,11-14,16H2,1-2H3,(H,24,27)