1-(3-chloranyl-4-fluoranyl-phenyl)-3-[[2-(2-propan-2-yloxyphenyl)quinolin-4-yl]carbonylamino]thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[[2-(2-propan-2-yloxyphenyl)quinolin-4-yl]carbonylamino]thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-[[2-(2-isopropoxyphenyl)quinoline-4-carbonyl]amino]thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[[oxo-[2-(2-propan-2-yloxyphenyl)-4-quinolinyl]methyl]amino]thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-[[2-(2-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-[[2-(2-isopropoxyphenyl)quinoline-4-carbonyl]amino]thiourea Formula: C26H22ClFN4O2S MolecularWeight: 508.994883

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)NNC(=S)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CC(C)OC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)NNC(=S)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C26H22ClFN4O2S/c1-15(2)34-24-10-6-4-8-18(24)23-14-19(17-7-3-5-9-22(17)30-23)25(33)31-32-26(35)29-16-11-12-21(28)20(27)13-16/h3-15H,1-2H3,(H,31,33)(H2,29,32,35)