1-(3-methoxypropyl)-3-[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]thiourea

Systemtic Name: 1-(3-methoxypropyl)-3-[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]thiourea Openeye Name: 1-(3-methoxypropyl)-3-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]thiourea CAS Name: 1-(3-methoxypropyl)-3-[[oxo-(2-pyridin-4-yl-4-quinolinyl)methyl]amino]thiourea IUPAC Name: 1-(3-methoxypropyl)-3-[(2-pyridin-4-ylquinoline-4-carbonyl)amino]thiourea Traditional Name: 1-(3-methoxypropyl)-3-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]thiourea Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=S)NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=NC=C3

Isomeric SMILES

COCCCNC(=S)NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=NC=C3

InChI

InChI=1S/C20H21N5O2S/c1-27-12-4-9-22-20(28)25-24-19(26)16-13-18(14-7-10-21-11-8-14)23-17-6-3-2-5-15(16)17/h2-3,5-8,10-11,13H,4,9,12H2,1H3,(H,24,26)(H2,22,25,28)