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

Systemtic Name: N,N-diethyl-3-[[(4-pyrazol-1-ylphenyl)carbonylamino]carbamoyl]benzenesulfonamide Openeye Name: N,N-diethyl-3-[[(4-pyrazol-1-ylbenzoyl)amino]carbamoyl]benzenesulfonamide CAS Name: N,N-diethyl-3-[oxo-[[oxo-[4-(1-pyrazolyl)phenyl]methyl]hydrazo]methyl]benzenesulfonamide IUPAC Name: N,N-diethyl-3-[[(4-pyrazol-1-ylbenzoyl)amino]carbamoyl]benzenesulfonamide Traditional Name: N,N-diethyl-3-[[(4-pyrazol-1-ylbenzoyl)amino]carbamoyl]benzenesulfonamide Formula: C21H23N5O4S MolecularWeight: 441.50342

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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=N3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)C2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C21H23N5O4S/c1-3-25(4-2)31(29,30)19-8-5-7-17(15-19)21(28)24-23-20(27)16-9-11-18(12-10-16)26-14-6-13-22-26/h5-15H,3-4H2,1-2H3,(H,23,27)(H,24,28)