N,N-diethyl-3-[[(4-pyrrol-1-ylphenyl)carbonylamino]carbamoyl]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-[[(4-pyrrol-1-ylphenyl)carbonylamino]carbamoyl]benzenesulfonamide Openeye Name: N,N-diethyl-3-[[(4-pyrrol-1-ylbenzoyl)amino]carbamoyl]benzenesulfonamide CAS Name: N,N-diethyl-3-[oxo-[[oxo-[4-(1-pyrrolyl)phenyl]methyl]hydrazo]methyl]benzenesulfonamide IUPAC Name: N,N-diethyl-3-[[(4-pyrrol-1-ylbenzoyl)amino]carbamoyl]benzenesulfonamide Traditional Name: N,N-diethyl-3-[[(4-pyrrol-1-ylbenzoyl)amino]carbamoyl]benzenesulfonamide Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)C2=CC=C(C=C2)N3C=CC=C3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)C2=CC=C(C=C2)N3C=CC=C3

InChI

InChI=1S/C22H24N4O4S/c1-3-26(4-2)31(29,30)20-9-7-8-18(16-20)22(28)24-23-21(27)17-10-12-19(13-11-17)25-14-5-6-15-25/h5-16H,3-4H2,1-2H3,(H,23,27)(H,24,28)