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

Systemtic Name: 1-methyl-3-[(2-pyridin-3-ylquinolin-4-yl)carbonylamino]thiourea Openeye Name: 1-methyl-3-[[2-(3-pyridyl)quinoline-4-carbonyl]amino]thiourea CAS Name: 1-methyl-3-[[oxo-[2-(3-pyridinyl)-4-quinolinyl]methyl]amino]thiourea IUPAC Name: 1-methyl-3-[(2-pyridin-3-ylquinoline-4-carbonyl)amino]thiourea Traditional Name: 1-methyl-3-[[2-(3-pyridyl)quinoline-4-carbonyl]amino]thiourea Formula: C17H15N5OS MolecularWeight: 337.3989

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CN=CC=C3

Isomeric SMILES

CNC(=S)NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CN=CC=C3

InChI

InChI=1S/C17H15N5OS/c1-18-17(24)22-21-16(23)13-9-15(11-5-4-8-19-10-11)20-14-7-3-2-6-12(13)14/h2-10H,1H3,(H,21,23)(H2,18,22,24)