3-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]carbonyl-N-prop-2-enyl-benzenesulfonamide

Systemtic Name: 3-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]carbonyl-N-prop-2-enyl-benzenesulfonamide Openeye Name: N-allyl-3-[4-(5-bromo-2-pyridyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: 3-[[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-oxomethyl]-N-prop-2-enylbenzenesulfonamide IUPAC Name: 3-[4-(5-bromopyridin-2-yl)piperazine-1-carbonyl]-N-prop-2-enylbenzenesulfonamide Traditional Name: N-allyl-3-[4-(5-bromo-2-pyridyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C19H21BrN4O3S MolecularWeight: 465.36404

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=NC=C(C=C3)Br

Isomeric SMILES

C=CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=NC=C(C=C3)Br

InChI

InChI=1S/C19H21BrN4O3S/c1-2-8-22-28(26,27)17-5-3-4-15(13-17)19(25)24-11-9-23(10-12-24)18-7-6-16(20)14-21-18/h2-7,13-14,22H,1,8-12H2