N-[4-[[(4-bromanyl-1H-pyrrol-2-yl)carbonylamino]carbamoyl]phenyl]-2,5-dimethyl-benzenesulfonamide

Systemtic Name: N-[4-[[(4-bromanyl-1H-pyrrol-2-yl)carbonylamino]carbamoyl]phenyl]-2,5-dimethyl-benzenesulfonamide Openeye Name: N-[4-[[(4-bromo-1H-pyrrole-2-carbonyl)amino]carbamoyl]phenyl]-2,5-dimethyl-benzenesulfonamide CAS Name: N-[4-[[[(4-bromo-1H-pyrrol-2-yl)-oxomethyl]hydrazo]-oxomethyl]phenyl]-2,5-dimethylbenzenesulfonamide IUPAC Name: N-[4-[[(4-bromo-1H-pyrrole-2-carbonyl)amino]carbamoyl]phenyl]-2,5-dimethylbenzenesulfonamide Traditional Name: N-[4-[[(4-bromo-1H-pyrrole-2-carbonyl)amino]carbamoyl]phenyl]-2,5-dimethyl-benzenesulfonamide Formula: C20H19BrN4O4S MolecularWeight: 491.35826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NNC(=O)C3=CC(=CN3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NNC(=O)C3=CC(=CN3)Br

InChI

InChI=1S/C20H19BrN4O4S/c1-12-3-4-13(2)18(9-12)30(28,29)25-16-7-5-14(6-8-16)19(26)23-24-20(27)17-10-15(21)11-22-17/h3-11,22,25H,1-2H3,(H,23,26)(H,24,27)