4-bromanyl-N-[4-[[(3-methylphenyl)carbonylamino]carbamoyl]phenyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[4-[[(3-methylphenyl)carbonylamino]carbamoyl]phenyl]benzenesulfonamide Openeye Name: 4-bromo-N-[4-[[(3-methylbenzoyl)amino]carbamoyl]phenyl]benzenesulfonamide CAS Name: 4-bromo-N-[4-[[[(3-methylphenyl)-oxomethyl]hydrazo]-oxomethyl]phenyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[4-[[(3-methylbenzoyl)amino]carbamoyl]phenyl]benzenesulfonamide Traditional Name: 4-bromo-N-[4-[(m-toluoylamino)carbamoyl]phenyl]benzenesulfonamide Formula: C21H18BrN3O4S MolecularWeight: 488.35432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H18BrN3O4S/c1-14-3-2-4-16(13-14)21(27)24-23-20(26)15-5-9-18(10-6-15)25-30(28,29)19-11-7-17(22)8-12-19/h2-13,25H,1H3,(H,23,26)(H,24,27)