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

Systemtic Name: 1-cyclohexyl-3-[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]thiourea Openeye Name: 1-cyclohexyl-3-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]thiourea CAS Name: 1-cyclohexyl-3-[[oxo-(2-pyridin-4-yl-4-quinolinyl)methyl]amino]thiourea IUPAC Name: 1-cyclohexyl-3-[(2-pyridin-4-ylquinoline-4-carbonyl)amino]thiourea Traditional Name: 1-cyclohexyl-3-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]thiourea Formula: C22H23N5OS MolecularWeight: 405.51592

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

Isomeric SMILES

C1CCC(CC1)NC(=S)NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

InChI

InChI=1S/C22H23N5OS/c28-21(26-27-22(29)24-16-6-2-1-3-7-16)18-14-20(15-10-12-23-13-11-15)25-19-9-5-4-8-17(18)19/h4-5,8-14,16H,1-3,6-7H2,(H,26,28)(H2,24,27,29)