4-chloranyl-N-[1-oxidanylidene-1-[4-(phenylmethyl)piperazin-1-yl]pentan-2-yl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[1-oxidanylidene-1-[4-(phenylmethyl)piperazin-1-yl]pentan-2-yl]benzenesulfonamide Openeye Name: N-[1-(4-benzylpiperazine-1-carbonyl)butyl]-4-chloro-benzenesulfonamide CAS Name: 4-chloro-N-[1-oxo-1-[4-(phenylmethyl)-1-piperazinyl]pentan-2-yl]benzenesulfonamide IUPAC Name: N-[1-(4-benzylpiperazin-1-yl)-1-oxopentan-2-yl]-4-chlorobenzenesulfonamide Traditional Name: N-[1-(4-benzylpiperazine-1-carbonyl)butyl]-4-chloro-benzenesulfonamide Formula: C22H28ClN3O3S MolecularWeight: 449.99402

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H28ClN3O3S/c1-2-6-21(24-30(28,29)20-11-9-19(23)10-12-20)22(27)26-15-13-25(14-16-26)17-18-7-4-3-5-8-18/h3-5,7-12,21,24H,2,6,13-17H2,1H3