1-[(2S,3S)-3-methyl-1-oxidanylidene-1-[2-(2-pyridin-2-ylquinolin-4-yl)carbonylhydrazinyl]pentan-2-yl]urea

Systemtic Name: 1-[(2S,3S)-3-methyl-1-oxidanylidene-1-[2-(2-pyridin-2-ylquinolin-4-yl)carbonylhydrazinyl]pentan-2-yl]urea Openeye Name: [(1S,2S)-2-methyl-1-[[[2-(2-pyridyl)quinoline-4-carbonyl]amino]carbamoyl]butyl]urea CAS Name: [(2S,3S)-3-methyl-1-oxo-1-[[oxo-[2-(2-pyridinyl)-4-quinolinyl]methyl]hydrazo]pentan-2-yl]urea IUPAC Name: [(2S,3S)-3-methyl-1-oxo-1-[2-(2-pyridin-2-ylquinoline-4-carbonyl)hydrazinyl]pentan-2-yl]urea Traditional Name: [(1S,2S)-2-methyl-1-[[[2-(2-pyridyl)quinoline-4-carbonyl]amino]carbamoyl]butyl]urea Formula: C22H24N6O3 MolecularWeight: 420.46436

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CC=N3)NC(=O)N

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CC=N3)NC(=O)N

InChI

InChI=1S/C22H24N6O3/c1-3-13(2)19(26-22(23)31)21(30)28-27-20(29)15-12-18(17-10-6-7-11-24-17)25-16-9-5-4-8-14(15)16/h4-13,19H,3H2,1-2H3,(H,27,29)(H,28,30)(H3,23,26,31)/t13-,19-/m0/s1