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

Systemtic Name: 1-(2-propan-2-ylphenyl)-3-[(2-pyridin-3-ylquinolin-4-yl)carbonylamino]thiourea Openeye Name: 1-(2-isopropylphenyl)-3-[[2-(3-pyridyl)quinoline-4-carbonyl]amino]thiourea CAS Name: 1-[[oxo-[2-(3-pyridinyl)-4-quinolinyl]methyl]amino]-3-(2-propan-2-ylphenyl)thiourea IUPAC Name: 1-(2-propan-2-ylphenyl)-3-[(2-pyridin-3-ylquinoline-4-carbonyl)amino]thiourea Traditional Name: 1-o-cumenyl-3-[[2-(3-pyridyl)quinoline-4-carbonyl]amino]thiourea Formula: C25H23N5OS MolecularWeight: 441.54802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=S)NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN=CC=C4

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=S)NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN=CC=C4

InChI

InChI=1S/C25H23N5OS/c1-16(2)18-9-3-5-11-21(18)28-25(32)30-29-24(31)20-14-23(17-8-7-13-26-15-17)27-22-12-6-4-10-19(20)22/h3-16H,1-2H3,(H,29,31)(H2,28,30,32)