N,N-diethyl-3-[[(1-pyrrolidin-1-ylcarbonylpiperidin-3-yl)carbonylamino]carbamoyl]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-[[(1-pyrrolidin-1-ylcarbonylpiperidin-3-yl)carbonylamino]carbamoyl]benzenesulfonamide Openeye Name: N,N-diethyl-3-[[[1-(pyrrolidine-1-carbonyl)piperidine-3-carbonyl]amino]carbamoyl]benzenesulfonamide CAS Name: N,N-diethyl-3-[oxo-[[oxo-[1-[oxo(1-pyrrolidinyl)methyl]-3-piperidinyl]methyl]hydrazo]methyl]benzenesulfonamide IUPAC Name: N,N-diethyl-3-[[[1-(pyrrolidine-1-carbonyl)piperidine-3-carbonyl]amino]carbamoyl]benzenesulfonamide Traditional Name: N,N-diethyl-3-[[[1-(pyrrolidine-1-carbonyl)nipecotoyl]amino]carbamoyl]benzenesulfonamide Formula: C22H33N5O5S MolecularWeight: 479.59292

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)C2CCCN(C2)C(=O)N3CCCC3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)C2CCCN(C2)C(=O)N3CCCC3

InChI

InChI=1S/C22H33N5O5S/c1-3-27(4-2)33(31,32)19-11-7-9-17(15-19)20(28)23-24-21(29)18-10-8-14-26(16-18)22(30)25-12-5-6-13-25/h7,9,11,15,18H,3-6,8,10,12-14,16H2,1-2H3,(H,23,28)(H,24,29)