N-prop-2-ynyl-4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-prop-2-ynyl-4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-prop-2-ynyl-4-[4-(2-pyridylmethyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: 4-[oxo-[4-(2-pyridinylmethyl)-1-piperazinyl]methyl]-N-prop-2-ynylbenzenesulfonamide IUPAC Name: N-prop-2-ynyl-4-[4-(pyridin-2-ylmethyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-propargyl-4-[4-(2-pyridylmethyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC=N3

Isomeric SMILES

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC=N3

InChI

InChI=1S/C20H22N4O3S/c1-2-10-22-28(26,27)19-8-6-17(7-9-19)20(25)24-14-12-23(13-15-24)16-18-5-3-4-11-21-18/h1,3-9,11,22H,10,12-16H2