3-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]carbonyl-N-prop-2-ynyl-benzenesulfonamide

Systemtic Name: 3-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]carbonyl-N-prop-2-ynyl-benzenesulfonamide Openeye Name: 3-[4-(3-chlorophenyl)sulfonylpiperazine-1-carbonyl]-N-prop-2-ynyl-benzenesulfonamide CAS Name: 3-[[4-(3-chlorophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-N-prop-2-ynylbenzenesulfonamide IUPAC Name: 3-[4-(3-chlorophenyl)sulfonylpiperazine-1-carbonyl]-N-prop-2-ynylbenzenesulfonamide Traditional Name: 3-[4-(3-chlorophenyl)sulfonylpiperazine-1-carbonyl]-N-propargyl-benzenesulfonamide Formula: C20H20ClN3O5S2 MolecularWeight: 481.9729

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C#CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H20ClN3O5S2/c1-2-9-22-30(26,27)18-7-3-5-16(14-18)20(25)23-10-12-24(13-11-23)31(28,29)19-8-4-6-17(21)15-19/h1,3-8,14-15,22H,9-13H2