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

Systemtic Name: 1-phenyl-3-[(2-pyridin-3-ylquinolin-4-yl)carbonylamino]thiourea Openeye Name: 1-phenyl-3-[[2-(3-pyridyl)quinoline-4-carbonyl]amino]thiourea CAS Name: 1-[[oxo-[2-(3-pyridinyl)-4-quinolinyl]methyl]amino]-3-phenylthiourea IUPAC Name: 1-phenyl-3-[(2-pyridin-3-ylquinoline-4-carbonyl)amino]thiourea Traditional Name: 1-phenyl-3-[[2-(3-pyridyl)quinoline-4-carbonyl]amino]thiourea Formula: C22H17N5OS MolecularWeight: 399.46828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17N5OS/c28-21(26-27-22(29)24-16-8-2-1-3-9-16)18-13-20(15-7-6-12-23-14-15)25-19-11-5-4-10-17(18)19/h1-14H,(H,26,28)(H2,24,27,29)