4-chloranyl-N,N-diethyl-3-[4-(thiophen-2-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-N,N-diethyl-3-[4-(thiophen-2-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: 4-chloro-N,N-diethyl-3-[4-(2-thienylmethyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: 4-chloro-N,N-diethyl-3-[oxo-[4-(thiophen-2-ylmethyl)-1-piperazinyl]methyl]benzenesulfonamide IUPAC Name: 4-chloro-N,N-diethyl-3-[4-(thiophen-2-ylmethyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: 4-chloro-N,N-diethyl-3-[4-(2-thenyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C20H26ClN3O3S2 MolecularWeight: 456.02174

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)N2CCN(CC2)CC3=CC=CS3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)N2CCN(CC2)CC3=CC=CS3

InChI

InChI=1S/C20H26ClN3O3S2/c1-3-24(4-2)29(26,27)17-7-8-19(21)18(14-17)20(25)23-11-9-22(10-12-23)15-16-6-5-13-28-16/h5-8,13-14H,3-4,9-12,15H2,1-2H3