4-chloranyl-N-propan-2-yl-3-[4-(pyridin-2-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-propan-2-yl-3-[4-(pyridin-2-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: 4-chloro-N-isopropyl-3-[4-(2-pyridylmethyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: 4-chloro-3-[oxo-[4-(2-pyridinylmethyl)-1-piperazinyl]methyl]-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-chloro-N-propan-2-yl-3-[4-(pyridin-2-ylmethyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: 4-chloro-N-isopropyl-3-[4-(2-pyridylmethyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C20H25ClN4O3S MolecularWeight: 436.9555

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)N2CCN(CC2)CC3=CC=CC=N3

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)N2CCN(CC2)CC3=CC=CC=N3

InChI

InChI=1S/C20H25ClN4O3S/c1-15(2)23-29(27,28)17-6-7-19(21)18(13-17)20(26)25-11-9-24(10-12-25)14-16-5-3-4-8-22-16/h3-8,13,15,23H,9-12,14H2,1-2H3