N-(phenylmethyl)-3-[[(1-pyrimidin-2-ylpiperidin-3-yl)carbonylamino]carbamoyl]benzenesulfonamide

Systemtic Name: N-(phenylmethyl)-3-[[(1-pyrimidin-2-ylpiperidin-3-yl)carbonylamino]carbamoyl]benzenesulfonamide Openeye Name: N-benzyl-3-[[(1-pyrimidin-2-ylpiperidine-3-carbonyl)amino]carbamoyl]benzenesulfonamide CAS Name: 3-[oxo-[[oxo-[1-(2-pyrimidinyl)-3-piperidinyl]methyl]hydrazo]methyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-3-[[(1-pyrimidin-2-ylpiperidine-3-carbonyl)amino]carbamoyl]benzenesulfonamide Traditional Name: N-benzyl-3-[[[1-(2-pyrimidyl)nipecotoyl]amino]carbamoyl]benzenesulfonamide Formula: C24H26N6O4S MolecularWeight: 494.56604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CC=N2)C(=O)NNC(=O)C3=CC(=CC=C3)S(=O)(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)C2=NC=CC=N2)C(=O)NNC(=O)C3=CC(=CC=C3)S(=O)(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C24H26N6O4S/c31-22(28-29-23(32)20-10-5-14-30(17-20)24-25-12-6-13-26-24)19-9-4-11-21(15-19)35(33,34)27-16-18-7-2-1-3-8-18/h1-4,6-9,11-13,15,20,27H,5,10,14,16-17H2,(H,28,31)(H,29,32)