3-[[(5-bromanylthiophen-3-yl)carbonylamino]carbamoyl]-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 3-[[(5-bromanylthiophen-3-yl)carbonylamino]carbamoyl]-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-3-[[(5-bromothiophene-3-carbonyl)amino]carbamoyl]benzenesulfonamide CAS Name: 3-[[[(5-bromo-3-thiophenyl)-oxomethyl]hydrazo]-oxomethyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-3-[[(5-bromothiophene-3-carbonyl)amino]carbamoyl]benzenesulfonamide Traditional Name: N-benzyl-3-[[(5-bromothiophene-3-carbonyl)amino]carbamoyl]benzenesulfonamide Formula: C19H16BrN3O4S2 MolecularWeight: 494.38204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)C3=CSC(=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)CNS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)C3=CSC(=C3)Br

InChI

InChI=1S/C19H16BrN3O4S2/c20-17-10-15(12-28-17)19(25)23-22-18(24)14-7-4-8-16(9-14)29(26,27)21-11-13-5-2-1-3-6-13/h1-10,12,21H,11H2,(H,22,24)(H,23,25)